data_2dod_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 2dod _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 ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.171 0 CA-C-O 120.819 0.258 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 14.8 tp -56.02 -47.3 78.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -58.01 -33.69 69.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.867 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.45 -67.17 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.104 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . 0.459 ' CG ' HD22 ' A' ' 697' ' ' LEU . 14.9 ptt180 -53.82 -47.22 71.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.849 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.3 mtt -54.99 -41.35 71.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -61.58 -43.48 98.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -57.47 -57.89 10.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.951 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.55 ' CE1' ' CE ' ' A' ' 669' ' ' MET . 25.1 t80 -51.99 -52.49 50.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.898 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 12.4 ttmt -55.89 -37.21 68.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.905 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.86 -52.16 66.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.838 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.55 ' CE ' ' CE1' ' A' ' 666' ' ' PHE . 2.8 ptt? -66.92 -37.46 84.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 29.6 mt -52.25 -48.86 64.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.938 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.8 tp -77.5 -45.75 24.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -57.1 -66.04 0.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 10.4 mmp_? -43.76 -25.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.872 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 89.2 43.84 5.19 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.515 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 40.4 t -68.06 97.87 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.853 0.359 . . . . 0.0 111.128 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 8.7 t -51.42 143.92 10.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.815 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -80.89 -42.08 22.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.133 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -82.94 47.67 1.25 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.885 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.8 m -131.9 -178.62 4.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.856 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 1.7 t -101.7 151.45 22.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.125 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.407 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 26.1 t-105 -59.43 -25.59 64.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.957 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.58 -56.64 14.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.904 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . 0.424 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 38.4 mttp -56.13 -59.04 5.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.882 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -54.92 -40.6 70.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.908 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.407 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 11.7 tp -51.77 -59.41 4.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.883 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.444 ' CD2' ' C ' ' A' ' 686' ' ' HIS . 3.1 p-80 -59.2 -29.81 67.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.475 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 45.9 mttm -68.03 -28.12 67.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.849 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 25.3 pt -117.88 10.45 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.113 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 4.7 p -74.4 -37.6 45.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.091 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.475 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 7.2 p90 -80.5 9.41 6.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.868 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.421 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 10.0 t70 -93.68 139.81 22.88 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.595 0.712 . . . . 0.0 110.858 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.421 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.9 Cg_endo -69.8 -43.06 2.85 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.671 2.247 . . . . 0.0 112.358 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.469 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 70.9 mtm180 -58.47 -21.66 52.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.644 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 1.8 t80 -67.04 -18.69 65.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 12.2 mt -97.29 7.26 46.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.469 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 83.4 mt -91.13 -31.2 16.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.459 HD22 ' CG ' ' A' ' 662' ' ' ARG . 27.2 mt -104.12 152.39 22.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.894 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -57.31 161.86 4.99 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.693 0.758 . . . . 0.0 110.887 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 -37.23 9.52 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.696 2.264 . . . . 0.0 112.362 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -72.1 -45.52 60.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' A' ' 702' ' ' ARG . 36.9 mt-10 -56.95 -53.15 61.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.899 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.644 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 47.5 mtt180 -36.28 -52.24 0.8 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.837 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -65.38 -45.07 85.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -56.35 -57.89 10.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.04 -29.98 42.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.109 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -71.08 -47.95 55.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -55.89 -52.64 63.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.881 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -60.33 -41.8 94.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.893 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -58.99 -41.22 87.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.858 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 78.2 t -68.95 -43.04 82.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.067 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -53.23 -51.25 62.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.894 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 47.3 p -66.74 -35.73 80.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.149 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.407 ' HA ' ' NE ' ' A' ' 713' ' ' ARG . 5.0 mmp_? -66.45 -29.47 69.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.14 179.894 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--O 1.232 0.195 0 CA-C-O 120.806 0.252 . . . . 0.0 112.335 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 26.4 tp -46.22 -47.58 17.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.933 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -57.65 -35.68 70.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.909 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.68 -70.46 0.26 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.104 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . 0.408 ' HG3' ' CD2' ' A' ' 697' ' ' LEU . 5.2 ptm180 -46.8 -51.63 16.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.885 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.1 mtt -56.97 -50.1 73.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.87 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -51.25 -41.83 60.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.899 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -61.49 -65.45 0.69 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.912 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.407 ' HB2' ' CD1' ' A' ' 697' ' ' LEU . 21.6 t80 -44.81 -49.12 10.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 43.7 tttt -63.22 -42.26 99.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -52.83 -36.39 58.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.402 ' HG2' ' NH1' ' A' ' 693' ' ' ARG . 6.3 mtm -73.81 -60.54 2.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 54.3 mt -39.23 -42.32 0.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.948 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.2 tp -78.46 -50.45 11.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.918 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -59.73 -65.91 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.858 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -41.83 -32.84 0.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.896 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 96.24 31.4 7.24 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.489 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 69.6 t -55.11 103.44 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.874 0.368 . . . . 0.0 111.116 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 59.3 m -59.3 137.51 57.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -72.96 1.6 8.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.092 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -121.86 24.02 9.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.88 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.6 t -105.72 161.95 13.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.839 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 11.5 p -88.66 147.8 24.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.172 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.492 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 56.1 t-105 -50.98 -28.07 9.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.9 -61.74 2.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.896 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . 0.559 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 0.6 OUTLIER -54.54 -59.06 5.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . 0.413 ' OE1' ' CZ ' ' A' ' 706' ' ' PHE . 9.0 mt-10 -54.8 -41.05 70.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.916 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.492 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 8.1 tp -52.43 -68.59 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.559 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 4.4 p-80 -50.18 -31.64 14.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.861 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 45.6 mttt -68.35 -28.29 67.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 24.3 pt -119.15 15.48 6.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.14 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . 0.409 ' CG1' ' N ' ' A' ' 690' ' ' PHE . 3.2 p -83.85 -39.36 14.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.141 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.409 ' N ' ' CG1' ' A' ' 689' ' ' VAL . 15.4 p90 -68.24 -20.93 64.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.868 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.413 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.6 t70 -72.11 139.75 82.47 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.619 0.723 . . . . 0.0 110.873 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.413 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.77 -38.74 7.36 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.681 2.254 . . . . 0.0 112.367 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.461 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 59.4 mtm180 -53.84 -27.49 30.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.868 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.644 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 15.7 t80 -63.0 -23.41 67.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.93 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 17.4 mt -100.75 18.03 20.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.95 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 74.2 mt -99.93 -41.53 7.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.909 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.408 ' CD2' ' HG3' ' A' ' 662' ' ' ARG . 29.2 mt -89.67 146.51 24.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.904 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 9.6 m-20 -47.09 161.47 0.3 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.627 0.727 . . . . 0.0 110.895 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -37.04 9.83 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.698 2.265 . . . . 0.0 112.34 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.02 -37.69 69.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.948 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.437 ' O ' ' C ' ' A' ' 702' ' ' ARG . 8.3 mt-10 -62.53 -55.3 28.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.879 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.644 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 50.1 mtm180 -34.5 -47.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.862 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 9.4 tppt? -71.2 -46.95 60.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.885 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -57.88 -59.98 4.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.901 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 96.1 t -52.62 -50.72 39.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.13 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . 0.413 ' CZ ' ' OE1' ' A' ' 684' ' ' GLU . 20.9 t80 -49.11 -46.06 44.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.898 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -57.8 -54.78 43.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.881 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -52.84 -47.3 67.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.895 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.517 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 12.3 t80 -52.53 -51.03 61.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.951 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 41.1 t -58.02 -50.7 77.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.115 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -44.69 -56.42 4.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.908 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 39.7 p -60.35 -47.33 86.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.116 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.517 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.1 mmm180 -54.72 -21.73 11.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.054 179.949 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . 0.411 ' HG2' ' CB ' ' A' ' 661' ' ' ALA . 53.5 Cg_endo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.83 0.263 . . . . 0.0 112.329 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 17.7 tp -58.78 -50.72 72.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . 0.47 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 6.0 tp10 -51.26 -34.43 32.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . 0.411 ' CB ' ' HG2' ' A' ' 658' ' ' PRO . . . -70.62 -71.07 0.26 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.085 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -48.01 -49.79 29.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.864 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.9 mtt -55.91 -45.7 78.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.878 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . 0.47 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 8.5 mmmt -55.83 -42.26 75.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.4 -56.52 21.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.571 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 25.8 t80 -50.15 -49.71 51.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 33.8 tttt -62.16 -36.71 82.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -45.21 92.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.866 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.459 ' CG ' ' O ' ' A' ' 666' ' ' PHE . 3.0 ptt? -72.26 -38.67 68.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.9 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 25.3 mt -52.17 -47.49 65.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.954 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 22.0 tp -77.02 -50.36 13.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.94 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -53.19 -66.05 0.45 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.885 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -43.95 -31.36 0.87 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.874 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 96.25 45.9 2.7 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.502 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 74.7 t -72.4 89.57 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.857 0.36 . . . . 0.0 111.12 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 41.9 m -56.83 123.84 16.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.871 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -56.62 -31.8 64.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.072 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -70.0 -22.88 63.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.871 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 24.5 t -67.1 173.62 3.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.845 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 25.2 p -104.42 158.21 16.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.165 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.461 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 44.9 t-105 -59.87 -33.19 71.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -60.97 -58.6 7.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.92 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . 0.478 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 63.6 mttt -57.15 -59.06 5.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.843 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -55.5 -38.28 68.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.853 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.461 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 5.1 tp -53.5 -52.95 57.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.933 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.478 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 3.0 p-80 -65.52 -29.12 69.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 61.7 mttt -68.72 -33.28 73.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.949 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . 0.42 HD11 ' CE ' ' A' ' 669' ' ' MET . 7.5 pt -111.04 6.91 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.137 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 8.0 p -66.03 -25.07 35.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.14 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.514 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 9.1 p90 -85.52 -47.15 10.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.514 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.4 t70 -34.28 142.05 0.23 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.626 0.727 . . . . 0.0 110.829 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.418 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.76 -39.32 6.66 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.715 2.276 . . . . 0.0 112.358 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.499 ' N ' ' OD1' ' A' ' 691' ' ' ASP . 11.9 mtm-85 -67.19 -21.58 65.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.859 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.417 ' CB ' ' O ' ' A' ' 688' ' ' ILE . 18.8 t80 -63.96 -18.77 64.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 18.9 mt -109.9 23.53 14.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.948 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.469 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 81.3 mt -105.12 -25.6 12.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.907 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 27.9 mt -110.5 144.56 39.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.895 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -50.75 163.12 0.5 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.584 0.707 . . . . 0.0 110.893 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -31.7 20.02 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.706 2.271 . . . . 0.0 112.299 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -45.04 61.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.902 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 5.5 mm-40 -59.07 -54.53 46.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.907 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.571 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 38.1 mtp180 -34.28 -50.43 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -68.0 -45.67 73.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . 0.409 ' N ' ' O ' ' A' ' 701' ' ' GLU . 10.9 mm-40 -58.23 -60.32 3.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.913 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.4 t -54.71 -46.63 73.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.167 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . 0.474 ' CE1' ' CG2' ' A' ' 710' ' ' VAL . 25.2 t80 -60.76 -41.4 95.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.907 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -54.92 -53.03 60.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.833 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -61.64 -39.04 89.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.929 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -63.99 -39.07 93.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.937 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . 0.474 ' CG2' ' CE1' ' A' ' 706' ' ' PHE . 86.6 t -69.6 -53.92 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.114 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 12.8 mtpp -48.14 -48.47 34.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 45.3 p -66.85 -38.95 87.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 12.6 mmt-85 -62.19 -47.16 85.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.104 179.917 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.169 0 CA-C-O 120.856 0.273 . . . . 0.0 112.323 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 21.9 tp -59.99 -48.82 80.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -51.95 -32.76 34.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.855 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -74.0 -68.83 0.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.087 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -48.7 -48.36 40.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.891 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 9.2 mtt -59.05 -51.26 70.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -50.39 -39.37 46.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -63.24 -58.16 8.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.862 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.565 ' CE2' ' HG2' ' A' ' 702' ' ' ARG . 23.2 t80 -51.9 -43.95 63.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.897 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 34.0 tttp -69.7 -39.25 77.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.859 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -57.67 -43.32 84.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.871 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -71.99 -37.95 69.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.892 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 27.1 mt -53.86 -46.54 71.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 42.9 tp -75.46 -51.28 13.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.953 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -54.85 -63.62 1.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 12.7 mmp_? -45.78 -24.29 0.36 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.881 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 86.44 44.42 5.87 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.527 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 54.9 t -70.11 107.81 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.812 0.339 . . . . 0.0 111.162 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 39.1 m -63.36 149.87 44.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -81.4 -52.94 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.131 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -57.79 -13.55 4.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.892 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -75.03 172.37 12.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.862 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 2.4 t -105.25 165.14 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.186 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.531 ' CZ2' HD11 ' A' ' 685' ' ' LEU . 40.6 t-105 -62.73 -26.52 68.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -61.47 -62.11 2.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . 0.405 ' O ' ' ND1' ' A' ' 686' ' ' HIS . 39.8 mttp -53.52 -58.94 5.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.914 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -55.48 -45.79 76.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.903 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.531 HD11 ' CZ2' ' A' ' 681' ' ' TRP . 6.7 tp -45.59 -55.11 6.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.906 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.486 ' C ' ' CD2' ' A' ' 686' ' ' HIS . 1.7 p-80 -64.13 -31.63 72.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.856 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.552 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 56.9 mttm -68.97 -22.84 64.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 8.7 pt -118.48 5.0 6.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.119 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.9 -27.95 34.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.141 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.552 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 6.7 p90 -86.1 3.66 41.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 693' ' ' ARG . 9.4 t70 -94.96 139.8 22.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.605 0.717 . . . . 0.0 110.864 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.8 -34.02 15.3 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.675 2.25 . . . . 0.0 112.323 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.469 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 16.8 mtm-85 -67.49 -20.03 65.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.881 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -65.8 -16.96 64.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.969 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.1 mt -113.27 16.84 18.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.921 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.469 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 54.8 mt -96.03 -19.68 19.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.846 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 30.8 mt -114.83 148.19 38.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.884 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 -50.1 161.91 0.54 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.6 0.715 . . . . 0.0 110.93 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -33.71 15.93 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.652 2.235 . . . . 0.0 112.288 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -72.01 -45.31 61.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.892 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 71.6 mm-40 -57.47 -53.47 57.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.565 ' HG2' ' CE2' ' A' ' 666' ' ' PHE . 10.7 mtp180 -34.42 -47.95 0.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -71.45 -45.35 62.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.892 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . 0.41 ' N ' ' O ' ' A' ' 701' ' ' GLU . 46.0 mm-40 -57.88 -59.26 5.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.906 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 91.6 t -55.62 -48.37 77.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.126 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -56.34 -43.8 79.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.917 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -55.32 -53.24 58.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.863 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -58.08 -38.83 77.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.887 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -62.8 -42.78 99.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.917 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 89.2 t -67.36 -41.61 86.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.163 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -59.14 -39.06 81.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.864 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 21.2 p -74.09 -40.38 62.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.123 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -66.17 -26.37 67.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.868 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.094 179.909 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 N--CA 1.465 -0.169 0 CA-C-O 120.866 0.277 . . . . 0.0 112.36 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 14.5 tp -51.91 -54.84 24.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.899 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -53.71 -35.86 61.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -64.0 -70.94 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.125 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -50.8 -48.14 59.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.831 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.5 mtt -54.05 -42.73 69.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.873 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -58.85 -47.4 84.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.902 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -55.42 -52.12 64.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.493 ' CD1' ' HE1' ' A' ' 669' ' ' MET . 25.1 t80 -54.46 -57.44 11.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.849 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 16.9 ttmt -54.63 -35.98 64.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.968 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -60.1 -52.85 63.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.493 ' HE1' ' CD1' ' A' ' 666' ' ' PHE . 2.7 ptt? -65.14 -36.58 84.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.901 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.423 HD12 ' CD2' ' A' ' 666' ' ' PHE . 32.0 mt -54.23 -49.35 69.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.889 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 31.2 tp -74.01 -52.02 14.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . 0.435 ' O ' ' N ' ' A' ' 674' ' ' GLY . 19.0 mt-10 -55.09 -65.77 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . 0.411 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 16.1 mmp_? -39.49 -28.54 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.838 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . 0.435 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 93.99 42.85 3.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.511 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 53.0 t -71.43 94.6 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.874 0.368 . . . . 0.0 111.131 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 57.7 m -58.83 125.41 23.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.85 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -64.72 -32.2 73.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.088 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -83.81 34.72 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.919 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.3 t -125.9 -175.03 3.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.897 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 12.9 t -106.17 158.76 16.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.13 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.401 ' CZ2' HD11 ' A' ' 685' ' ' LEU . 50.1 t-105 -63.28 -38.07 89.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.887 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -54.28 -57.13 12.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.911 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . 0.413 ' HB3' ' NZ ' ' A' ' 687' ' ' LYS . 5.9 mtpm? -60.64 -59.62 5.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.905 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -52.55 -34.69 51.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.401 HD11 ' CZ2' ' A' ' 681' ' ' TRP . 8.3 tp -59.11 -62.1 2.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.584 ' CD2' ' N ' ' A' ' 687' ' ' LYS . 1.5 p-80 -50.58 -35.06 28.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.848 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.584 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 44.0 mttp -63.87 -40.03 95.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.911 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 12.0 pt -105.22 13.9 7.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.137 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 3.1 p -79.81 -24.32 12.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.161 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 12.2 p90 -75.42 -44.35 44.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.852 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.471 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 7.3 t70 -53.13 139.42 45.08 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.619 0.723 . . . . 0.0 110.832 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.406 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.2 Cg_endo -69.77 -34.77 13.87 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.715 2.277 . . . . 0.0 112.345 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.461 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 36.6 mtm180 -58.41 -17.45 20.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.896 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -66.61 -15.55 63.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.892 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 27.8 mt -103.65 -12.31 17.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.926 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 64.7 mt -62.42 -52.76 62.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.454 ' CD1' ' HB2' ' A' ' 666' ' ' PHE . 30.6 mt -84.67 148.05 26.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -56.22 162.47 3.03 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.634 0.73 . . . . 0.0 110.91 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . 0.537 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.8 Cg_endo -69.7 -32.12 19.43 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.731 2.287 . . . . 0.0 112.352 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 44.1 mttt -72.29 -46.81 54.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.899 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -60.34 -51.76 68.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.92 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.537 HH21 ' N ' ' A' ' 699' ' ' PRO . 44.6 mtm180 -39.27 -45.38 1.39 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.9 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -70.91 -43.49 68.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.907 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -60.89 -59.54 5.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.94 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.8 t -54.65 -41.45 55.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.114 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -60.18 -48.33 82.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -54.02 -47.29 71.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.803 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -65.95 -41.26 91.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.892 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.511 ' CZ ' ' HG3' ' A' ' 713' ' ' ARG . 12.6 t80 -61.82 -47.9 83.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.892 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 92.9 t -59.46 -43.99 91.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.1 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -57.31 -49.2 76.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.915 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 13.8 p -64.63 -41.46 96.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.128 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.511 ' HG3' ' CZ ' ' A' ' 709' ' ' TYR . 3.4 mmp_? -64.63 -36.62 84.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.888 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.113 179.91 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.847 0.27 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 10.4 tp -58.47 -48.62 80.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -55.36 -37.51 67.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -63.76 -66.1 0.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.124 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . 0.457 ' HG3' ' CD2' ' A' ' 697' ' ' LEU . 11.2 ptt180 -51.5 -48.22 62.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.915 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.0 mtt -56.08 -47.58 77.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.906 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -52.59 -45.62 66.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.912 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -58.28 -62.35 1.9 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.926 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -45.1 -55.61 5.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.892 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -54.74 -48.11 72.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.882 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -47.84 -41.58 24.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.405 ' O ' ' C ' ' A' ' 670' ' ' LEU . 5.5 mtm -67.53 -63.96 0.95 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.883 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.405 ' C ' ' O ' ' A' ' 669' ' ' MET . 44.6 mt -38.01 -34.85 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.916 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 15.9 tp -83.25 -56.03 4.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -54.71 -64.32 0.87 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.904 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . 0.403 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 2.5 mmp_? -44.38 -29.68 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.897 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 90.29 33.22 8.88 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.473 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.9 116.29 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 0.0 111.135 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 58.1 m -75.3 144.92 42.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.888 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -82.68 -28.98 30.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.076 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -77.33 -2.06 33.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.853 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.2 m -90.57 -177.84 5.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.862 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 65.8 p -104.46 160.88 14.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.183 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.546 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 29.7 t-105 -64.75 -27.08 68.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.882 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -61.47 -58.83 6.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.868 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 17.0 mttm -55.73 -58.98 5.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.91 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -56.19 -44.85 79.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.869 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.546 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 6.4 tp -46.55 -62.26 1.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.929 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 3.5 p-80 -58.63 -30.62 67.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.868 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 43.5 mttm -69.34 -20.99 63.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 30.0 pt -122.68 8.31 5.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.189 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 3.2 p -77.7 -29.0 15.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.156 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.462 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 12.0 p90 -70.56 -44.43 67.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.915 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.462 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.6 t70 -53.22 139.76 45.19 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.573 0.702 . . . . 0.0 110.911 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.3 Cg_endo -69.67 -34.29 15.19 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.713 2.275 . . . . 0.0 112.369 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.461 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 16.5 mtm-85 -56.63 -24.39 47.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.874 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.432 ' CZ ' ' HD2' ' A' ' 702' ' ' ARG . 22.0 t80 -65.92 -17.88 64.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.888 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 15.8 mt -107.19 23.13 14.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 78.5 mt -104.22 -29.5 10.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.89 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.457 ' CD2' ' HG3' ' A' ' 662' ' ' ARG . 26.7 mt -102.84 151.22 22.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.897 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 23.4 m-20 -50.74 161.85 0.62 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.635 0.731 . . . . 0.0 110.892 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . 0.415 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 54.1 Cg_endo -69.74 -37.1 9.69 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.725 2.283 . . . . 0.0 112.347 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -72.19 -39.28 68.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.916 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.451 ' O ' ' C ' ' A' ' 702' ' ' ARG . 35.7 mm-40 -59.88 -53.94 51.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.904 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.451 ' C ' ' O ' ' A' ' 701' ' ' GLU . 29.0 mtm105 -34.1 -48.03 0.3 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.914 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 16.5 tptt -72.35 -43.74 63.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.953 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' A' ' 701' ' ' GLU . 29.1 mt-30 -57.28 -56.92 15.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.908 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.72 -48.59 88.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.148 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -57.2 -36.73 71.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.863 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -64.87 -51.5 61.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.864 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -58.2 -36.34 72.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -67.18 -41.48 85.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.974 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 96.7 t -69.42 -39.3 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.151 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 17.1 tttm -62.99 -40.58 98.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 73.0 p -75.13 -38.59 61.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.13 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 5.8 mmm180 -60.23 -36.29 77.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.111 179.907 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo . . . . . 0 C--O 1.232 0.222 0 CA-C-O 120.872 0.28 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . 0.415 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 15.2 tp -49.93 -49.74 48.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.87 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -54.35 -41.16 68.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.918 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -62.31 -70.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.091 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . 0.415 ' NE ' ' HA ' ' A' ' 659' ' ' LEU . 7.6 ptt180 -48.46 -46.76 38.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.878 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.3 mtt -57.5 -46.53 83.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.846 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 3.7 mmmm -53.43 -45.83 69.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.887 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -58.16 -60.91 3.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.897 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.531 ' CD1' ' HE3' ' A' ' 669' ' ' MET . 18.0 t80 -48.72 -58.74 4.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.922 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 51.5 tttt -51.84 -37.45 52.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.919 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -58.71 -54.18 49.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.896 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.531 ' HE3' ' CD1' ' A' ' 666' ' ' PHE . 2.7 ptt? -65.42 -37.07 85.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.908 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 30.0 mt -52.0 -50.62 60.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 37.7 tp -74.74 -47.36 31.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -56.74 -66.08 0.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.906 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -42.64 -25.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.853 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 85.98 44.34 6.04 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.479 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . 0.418 HG11 ' CD ' ' A' ' 684' ' ' GLU . 25.8 t -68.37 109.62 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.784 0.326 . . . . 0.0 111.1 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 24.5 m -67.51 136.45 54.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.831 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -69.58 -55.74 9.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.125 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -54.27 -30.81 51.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.852 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.9 m -55.83 167.14 0.61 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.863 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 44.8 p -93.88 153.45 18.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.154 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 33.9 t-105 -57.47 -26.1 60.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.933 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.25 -60.24 3.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.881 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -54.03 -59.07 5.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.87 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . 0.418 ' CD ' HG11 ' A' ' 675' ' ' VAL . 59.6 mm-40 -54.39 -43.98 71.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 7.0 tp -48.23 -57.63 5.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.51 ' CD2' ' C ' ' A' ' 686' ' ' HIS . 1.5 p-80 -59.29 -33.74 71.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.839 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.475 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 24.5 mttp -65.29 -26.08 67.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 16.4 pt -117.29 7.87 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.153 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 3.2 p -76.88 -35.91 24.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.11 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.451 ' CE1' ' O ' ' A' ' 687' ' ' LYS . 47.9 p90 -83.41 13.84 4.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 693' ' ' ARG . 2.9 t70 -102.46 143.61 26.95 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.614 0.721 . . . . 0.0 110.843 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.416 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.74 -46.81 1.1 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.688 2.259 . . . . 0.0 112.332 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.497 ' N ' ' OD1' ' A' ' 691' ' ' ASP . 54.8 mtm180 -53.96 -26.06 23.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.607 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 0.7 OUTLIER -66.48 -27.92 68.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.938 -179.858 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.9 mt -89.0 2.85 53.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.964 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.469 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 94.8 mt -86.98 -42.22 13.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.912 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.416 ' O ' ' NE ' ' A' ' 702' ' ' ARG . 29.7 mt -91.17 144.46 25.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.891 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -51.41 161.85 0.75 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.58 0.705 . . . . 0.0 110.923 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -35.1 13.31 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.682 2.255 . . . . 0.0 112.34 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -72.09 -45.95 58.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -59.38 -45.55 91.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.839 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.607 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 42.0 mtt180 -43.45 -45.14 6.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.822 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.11 -44.68 62.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.875 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -57.6 -60.0 4.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.93 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 72.2 t -55.21 -47.12 77.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.159 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -56.59 -41.25 76.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.897 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -59.12 -49.54 77.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.848 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -62.04 -42.63 99.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.93 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.567 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 7.0 t80 -58.75 -37.67 76.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.958 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 96.8 t -69.88 -45.89 75.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.162 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 26.9 tttm -51.95 -51.94 53.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.903 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 3.9 p -68.81 -31.1 69.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.175 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.567 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 3.2 mmm180 -65.96 -33.76 76.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.924 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.138 179.879 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 C--O 1.232 0.19 0 CA-C-O 120.856 0.273 . . . . 0.0 112.352 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . 0.42 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 13.2 tp -49.25 -44.51 43.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -58.95 -42.26 89.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -61.0 -65.06 0.75 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.065 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . 0.42 ' NE ' ' HA ' ' A' ' 659' ' ' LEU . 10.3 ptt180 -53.18 -54.33 37.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.904 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.7 mtt -51.47 -46.06 62.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.846 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.4 -43.4 71.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -59.55 -58.76 7.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.894 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.44 ' HB2' ' CD1' ' A' ' 697' ' ' LEU . 26.9 t80 -50.64 -51.31 50.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.89 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -60.89 -35.35 76.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.927 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -61.8 -56.61 17.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -59.87 -36.24 76.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.887 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 34.6 mt -56.95 -48.59 77.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.906 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.77 -45.23 62.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' A' ' 674' ' ' GLY . 23.2 mt-10 -61.67 -65.81 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -41.5 -24.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 86.71 46.86 5.02 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.452 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . 0.413 HG12 ' CD ' ' A' ' 684' ' ' GLU . 24.4 t -72.22 106.4 2.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.829 0.347 . . . . 0.0 111.13 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 9.3 t -65.59 140.02 58.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.866 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -78.75 -44.07 24.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.072 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -63.78 -20.89 66.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.4 m -69.04 -175.52 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.868 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 12.5 t -106.61 167.24 9.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.136 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.498 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 31.4 t-105 -69.13 -26.8 65.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.866 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -61.2 -63.01 1.43 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.875 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -52.67 -59.03 4.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . 0.413 ' CD ' HG12 ' A' ' 675' ' ' VAL . 49.1 mm-40 -55.51 -44.54 76.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.498 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.3 tp -47.79 -55.99 8.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.914 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.487 ' C ' ' CD2' ' A' ' 686' ' ' HIS . 1.8 p-80 -61.9 -31.82 72.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.469 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 82.5 mttt -66.66 -24.91 66.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.918 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 20.9 pt -120.68 9.01 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.103 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 4.0 p -75.22 -26.69 18.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.175 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -84.65 -39.05 19.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.877 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.422 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 8.6 t70 -43.59 139.78 2.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.655 0.741 . . . . 0.0 110.867 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.82 -36.28 10.94 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.638 2.225 . . . . 0.0 112.357 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.468 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 57.0 mtm180 -65.16 -20.07 66.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.856 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.573 ' CD1' ' C ' ' A' ' 694' ' ' TYR . 0.6 OUTLIER -66.03 -21.29 66.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.926 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 52.1 mt -93.89 -13.76 26.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.905 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.468 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 63.7 mt -67.47 -52.05 43.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.44 ' CD1' ' HB2' ' A' ' 666' ' ' PHE . 33.3 mt -79.72 147.23 32.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.91 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -51.51 162.54 0.69 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.627 0.727 . . . . 0.0 110.89 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . 0.412 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 53.5 Cg_endo -69.75 -36.61 10.51 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.683 2.255 . . . . 0.0 112.335 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -72.19 -41.68 66.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 15.7 mt-10 -58.68 -51.22 70.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.567 ' HD2' ' CE2' ' A' ' 694' ' ' TYR . 24.7 mtm105 -34.23 -50.88 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.849 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -70.56 -46.2 63.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -55.47 -61.16 2.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.926 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 65.9 t -54.06 -45.19 65.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.086 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.68 -52.42 63.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.866 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -51.13 -47.19 62.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -63.4 -39.82 95.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.555 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 20.3 t80 -63.69 -49.63 72.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.921 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 82.4 t -55.93 -42.49 71.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.128 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -60.3 -46.17 90.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.899 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 15.8 p -65.8 -37.33 86.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.119 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.555 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.3 mmm180 -67.04 -28.73 68.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.104 179.964 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.232 0.199 0 CA-C-O 120.811 0.255 . . . . 0.0 112.34 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 31.4 tp -54.69 -51.11 66.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.933 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 12.0 mm-40 -55.64 -30.5 61.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.92 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -71.84 -70.99 0.3 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.126 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . 0.462 ' CZ ' HD23 ' A' ' 697' ' ' LEU . 0.1 OUTLIER -48.35 -52.69 20.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.897 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 6.0 mtt -54.84 -48.48 72.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . 0.467 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 1.7 mmmm -53.16 -37.45 61.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.916 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -64.01 -56.42 15.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.906 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.535 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 29.4 t80 -52.31 -47.61 65.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 41.3 tttt -67.26 -34.26 77.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.92 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -62.99 -44.76 95.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.877 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.441 ' HE2' ' CE1' ' A' ' 666' ' ' PHE . 2.8 ptt? -70.35 -32.36 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 40.8 mt -60.85 -49.82 75.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.892 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.5 tp -70.89 -55.91 7.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.942 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . 0.405 ' C ' ' N ' ' A' ' 674' ' ' GLY . 15.9 mt-10 -49.31 -63.58 1.06 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . 0.431 ' CG ' ' O ' ' A' ' 669' ' ' MET . 4.6 mmp_? -45.67 -21.31 0.11 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.843 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . 0.405 ' N ' ' C ' ' A' ' 672' ' ' GLU . . . 85.7 46.02 5.57 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.486 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 70.9 t -78.32 103.56 5.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 111.142 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 16.4 m -67.7 158.51 32.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.871 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -88.57 -36.81 16.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.072 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -66.55 -10.08 41.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.919 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.1 m -82.7 175.49 10.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.822 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 59.4 p -102.44 178.33 4.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.172 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.462 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 50.6 t-105 -76.08 -25.22 55.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.933 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -67.15 -56.76 8.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.883 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . 0.498 ' O ' ' CD2' ' A' ' 686' ' ' HIS . 59.6 mttm -53.94 -59.03 5.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.875 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -57.77 -45.8 85.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.462 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 7.9 tp -45.27 -53.38 8.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.921 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.498 ' CD2' ' O ' ' A' ' 683' ' ' LYS . 1.7 p80 -68.41 -28.65 67.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.897 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.562 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 37.9 mttm -68.96 -21.12 64.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 26.1 pt -121.96 -0.38 7.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.115 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 8.7 p -62.82 -25.32 38.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.13 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.562 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 18.6 p90 -93.59 11.66 28.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.835 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.428 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.5 t70 -99.3 139.85 21.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.596 0.712 . . . . 0.0 110.877 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.78 -31.78 19.78 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.688 2.259 . . . . 0.0 112.302 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 22.4 mtm-85 -67.21 -21.49 65.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.841 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.473 ' O ' ' CD1' ' A' ' 694' ' ' TYR . 10.6 t80 -68.55 -5.53 20.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.1 mt -120.91 14.8 11.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.944 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 55.5 mt -95.51 -26.18 15.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.939 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.462 HD23 ' CZ ' ' A' ' 662' ' ' ARG . 29.8 mt -112.12 155.56 23.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.47 158.52 4.02 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.603 0.716 . . . . 0.0 110.884 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . 0.408 ' HA ' ' NE ' ' A' ' 702' ' ' ARG . 53.2 Cg_endo -69.82 -33.73 15.77 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.626 2.217 . . . . 0.0 112.345 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -72.69 -46.01 55.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.945 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' A' ' 704' ' ' GLN . 0.4 OUTLIER -62.35 -54.52 39.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.877 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.535 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 57.0 mtm180 -34.21 -48.29 0.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.902 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.57 -41.34 69.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.901 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 701' ' ' GLU . 21.5 mm-40 -60.39 -56.63 19.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 33.2 t -57.31 -43.25 81.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.116 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -62.17 -37.93 87.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.891 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -60.86 -49.86 75.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.863 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -61.44 -35.34 77.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.525 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 0.8 OUTLIER -65.65 -35.98 82.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.954 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 93.5 t -70.95 -51.3 36.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.135 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 12.9 ttmt -56.8 -35.81 69.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.918 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 15.6 p -75.1 -39.78 60.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.184 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.525 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 2.4 mmp_? -64.32 -35.66 81.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.85 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.112 179.918 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.232 0.187 0 CA-C-O 120.815 0.256 . . . . 0.0 112.338 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . 0.422 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 18.6 tp -48.05 -49.05 32.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -55.53 -41.13 72.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -61.47 -67.64 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . 0.45 ' HG3' ' CD2' ' A' ' 697' ' ' LEU . 7.9 ptt180 -51.14 -46.4 61.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.869 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 6.7 mtt -58.83 -49.47 77.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.895 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 16.3 mtmt -49.62 -46.24 49.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . 0.471 ' OE1' ' CD1' ' A' ' 696' ' ' LEU . 86.4 mt-30 -59.33 -64.1 1.06 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.885 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.549 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 27.6 t80 -41.52 -56.95 2.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.88 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 35.1 tttp -54.94 -47.41 74.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -50.59 -33.17 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.854 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.423 ' O ' ' C ' ' A' ' 670' ' ' LEU . 5.4 mtm -74.58 -65.79 0.82 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' A' ' 669' ' ' MET . 83.6 mt -35.3 -40.91 0.15 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.89 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.9 tp -76.67 -58.15 3.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.934 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 674' ' ' GLY . 8.3 mm-40 -57.78 -64.3 0.95 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . 0.434 ' C ' ' O ' ' A' ' 672' ' ' GLU . 4.2 mmp_? -35.02 -34.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.873 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 98.03 42.27 3.09 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.419 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 94.9 t -75.56 136.94 23.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.844 0.354 . . . . 0.0 111.156 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 15.9 m -103.7 121.89 43.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.841 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -45.98 -57.88 4.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.121 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -46.46 -30.24 2.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.902 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.87 160.72 11.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.854 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 14.4 t -82.33 -177.74 6.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.146 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.546 ' CZ2' HD12 ' A' ' 685' ' ' LEU . 19.3 t-105 -84.3 -34.52 23.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.938 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -64.32 -59.86 3.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . 0.443 ' O ' ' ND1' ' A' ' 686' ' ' HIS . 12.4 mtpt -46.25 -58.94 3.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.915 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -62.64 -47.58 83.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.852 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.546 HD12 ' CZ2' ' A' ' 681' ' ' TRP . 7.3 tp -43.16 -48.54 6.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.92 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.524 ' CD2' ' C ' ' A' ' 686' ' ' HIS . 0.9 OUTLIER -70.42 -38.43 74.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.85 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.517 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 44.3 mttp -60.56 -19.56 57.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.835 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 19.5 pt -115.39 -16.78 8.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.147 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . 0.444 HG13 ' N ' ' A' ' 690' ' ' PHE . 3.2 p -55.26 -32.41 28.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.143 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.444 ' N ' HG13 ' A' ' 689' ' ' VAL . 2.9 p90 -62.74 -36.41 82.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.861 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.423 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 8.5 t70 -64.0 139.74 97.73 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.609 0.719 . . . . 0.0 110.848 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.8 -36.92 9.82 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.708 2.272 . . . . 0.0 112.315 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.46 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 22.3 mtm-85 -56.39 -19.72 16.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.852 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.614 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 27.5 t80 -66.76 -18.5 65.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.894 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 20.1 mt -96.3 -3.85 43.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.471 ' CD1' ' OE1' ' A' ' 665' ' ' GLN . 83.0 mt -77.09 -43.72 33.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.911 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.45 ' CD2' ' HG3' ' A' ' 662' ' ' ARG . 31.9 mt -89.88 152.24 21.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.904 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 24.2 m-20 -61.84 162.1 18.56 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.663 0.744 . . . . 0.0 110.849 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . 0.403 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.4 Cg_endo -69.7 -34.06 15.57 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.694 2.262 . . . . 0.0 112.364 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 29.3 mttm -72.13 -47.07 53.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 24.4 mt-10 -60.75 -56.53 20.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.903 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.614 ' NH1' ' CE2' ' A' ' 694' ' ' TYR . 46.0 mtm180 -34.59 -45.41 0.24 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.849 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.34 -45.76 62.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . 0.435 ' N ' ' O ' ' A' ' 701' ' ' GLU . 11.2 mm100 -57.12 -50.35 73.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.914 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.64 -39.24 83.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.11 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -65.22 -36.84 85.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.859 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -64.68 -52.39 57.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.88 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . 0.45 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 5.5 pt20 -60.67 -36.65 79.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.913 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.47 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 11.7 t80 -66.76 -39.5 87.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.924 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 99.6 t -64.55 -45.63 95.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.196 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.38 -52.22 66.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.9 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 18.4 p -60.16 -37.79 81.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.157 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.47 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 3.4 mmp_? -65.11 -38.28 90.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.902 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.142 179.882 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.821 0.259 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 25.3 tp -51.14 -48.57 61.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.938 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . 0.485 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 14.1 pt-20 -56.03 -36.19 67.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.87 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.41 -71.07 0.22 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.148 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -46.53 -56.98 5.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.9 mtt -50.69 -49.8 56.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.902 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . 0.485 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 2.5 mmmm -51.74 -41.09 61.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.91 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -60.8 -56.46 20.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.883 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.552 ' CD1' ' HE3' ' A' ' 669' ' ' MET . 24.8 t80 -51.73 -55.55 19.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.83 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -54.89 -35.86 64.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.928 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -60.14 -47.58 85.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.856 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.552 ' HE3' ' CD1' ' A' ' 666' ' ' PHE . 2.9 ptt? -72.75 -36.4 67.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.894 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 33.1 mt -52.42 -51.19 60.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.965 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 23.3 tp -76.96 -53.62 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.939 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -49.64 -61.44 2.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.874 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 15.6 mmp_? -49.42 -19.57 0.56 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 82.09 44.34 7.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.45 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 71.7 t -70.13 103.54 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.839 0.352 . . . . 0.0 111.136 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 19.4 t -63.0 145.54 55.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.824 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -81.58 -36.85 28.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.1 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -72.75 -9.11 58.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.865 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.1 m -80.94 168.13 19.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.885 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 15.2 t -95.81 173.62 7.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.182 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.467 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 57.0 t-105 -70.64 -30.82 67.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.876 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -59.79 -59.16 5.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . 0.562 ' HA ' ' CD2' ' A' ' 686' ' ' HIS . 38.5 mttm -56.78 -59.01 5.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -55.51 -39.27 70.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.872 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.467 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 8.0 tp -53.37 -59.6 4.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.868 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.562 ' CD2' ' HA ' ' A' ' 683' ' ' LYS . 2.0 p80 -60.02 -27.6 67.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.879 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.532 ' HG3' ' CE1' ' A' ' 686' ' ' HIS . 47.6 mttm -69.25 -34.18 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.877 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 7.5 pt -111.26 9.66 8.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.125 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 9.8 p -70.25 -32.71 51.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.117 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 5.2 p90 -77.1 -38.49 52.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.864 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.447 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 9.1 t70 -50.94 139.76 21.96 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.559 0.695 . . . . 0.0 110.887 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.2 Cg_endo -69.76 -37.82 8.64 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.693 2.262 . . . . 0.0 112.329 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.447 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 14.4 mtm-85 -58.87 -20.98 56.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.88 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.438 ' OH ' ' CD1' ' A' ' 685' ' ' LEU . 61.8 t80 -69.2 -7.76 39.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.912 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 33.2 mt -119.07 20.48 12.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.447 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 96.7 mt -104.57 -34.98 8.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.934 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 29.1 mt -101.55 144.34 30.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.92 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -48.7 161.88 0.39 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.659 0.742 . . . . 0.0 110.842 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . 0.412 ' HA ' ' NE ' ' A' ' 702' ' ' ARG . 54.3 Cg_endo -69.7 -33.88 15.89 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.693 2.262 . . . . 0.0 112.358 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 3.9 mptt -72.15 -44.96 62.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.836 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.508 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -61.28 -50.74 71.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.895 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.412 ' NE ' ' HA ' ' A' ' 699' ' ' PRO . 53.8 mtm180 -39.97 -45.28 1.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . 0.406 ' HD2' ' C ' ' A' ' 703' ' ' LYS . 2.0 tmmm? -71.68 -43.89 65.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.857 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -58.62 -58.17 9.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.0 t -57.56 -40.66 76.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.107 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -66.78 -30.66 70.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.922 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . 0.428 ' C ' ' OD1' ' A' ' 707' ' ' ASP . 0.8 OUTLIER -66.44 -55.28 16.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.864 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -57.9 -41.72 83.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.936 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.539 ' C ' ' CD1' ' A' ' 709' ' ' TYR . 0.8 OUTLIER -60.2 -41.01 92.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.953 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 92.8 t -63.56 -50.42 78.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.085 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -51.14 -51.62 51.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.907 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 2.3 p -60.18 -40.47 90.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.122 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.527 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 2.6 mmp_? -66.16 -26.96 67.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.842 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.094 179.954 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.83 0.263 . . . . 0.0 112.333 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 23.7 tp -56.19 -48.71 75.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . 0.462 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 29.3 mt-10 -56.05 -32.64 64.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.848 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -69.97 -69.98 0.32 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.135 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -45.56 -48.09 14.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.855 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.5 mtt -56.39 -54.02 50.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.897 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . 0.462 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 3.3 mmpt? -48.37 -46.49 36.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -55.62 -63.37 1.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.44 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 22.8 t80 -45.38 -52.43 9.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.922 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -58.35 -44.22 88.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.861 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -51.47 -39.75 58.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.829 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 16.3 mtm -68.73 -58.6 3.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 52.6 mt -43.11 -38.37 2.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.911 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 15.4 tp -80.41 -58.88 2.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -52.85 -64.36 0.84 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.904 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -46.3 -25.76 0.69 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.821 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 85.78 31.07 22.04 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.468 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 24.4 t -53.84 108.74 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.857 0.36 . . . . 0.0 111.142 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 8.3 t -64.55 149.71 48.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.87 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -82.56 -39.82 21.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.118 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -66.53 -24.69 66.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.858 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.8 m -63.66 171.0 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.884 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 10.8 t -100.25 166.07 11.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 52.6 t-105 -63.53 -33.32 75.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.897 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -58.79 -56.11 26.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.88 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -57.7 -59.08 5.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.881 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -55.99 -37.67 69.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.894 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 18.0 tp -53.75 -58.79 5.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.446 ' CD2' ' C ' ' A' ' 686' ' ' HIS . 2.5 p-80 -59.4 -32.03 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.822 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.549 ' O ' ' CE2' ' A' ' 690' ' ' PHE . 40.9 mttm -66.17 -29.03 69.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.868 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 20.1 pt -114.75 8.16 7.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.141 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 4.0 p -75.37 -34.53 30.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.127 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.549 ' CE2' ' O ' ' A' ' 687' ' ' LYS . 51.3 p90 -81.85 12.67 3.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.896 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.425 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 11.2 t70 -101.23 139.9 20.83 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.581 0.705 . . . . 0.0 110.849 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.72 -40.07 5.82 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.676 2.251 . . . . 0.0 112.347 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.424 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 16.1 mtm-85 -61.43 -30.96 70.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.836 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.442 ' CE1' ' HD3' ' A' ' 702' ' ' ARG . 41.2 t80 -59.91 -12.93 8.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.911 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.402 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 28.4 mt -108.58 19.76 19.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.911 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.424 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 97.6 mt -101.73 -48.59 4.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.876 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 29.0 mt -82.71 146.84 28.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.902 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -49.95 161.65 0.54 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.642 0.734 . . . . 0.0 110.92 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -34.31 14.96 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.723 2.282 . . . . 0.0 112.356 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -72.09 -45.23 61.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.897 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 702' ' ' ARG . 67.7 mm-40 -58.6 -50.77 72.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.9 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.442 ' HD3' ' CE1' ' A' ' 694' ' ' TYR . 68.7 mtt180 -35.82 -49.24 0.6 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.892 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 10.8 tptp -71.76 -44.83 63.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.854 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -57.46 -62.25 1.91 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.929 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 66.7 t -53.77 -48.43 61.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.17 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . 0.507 ' CE1' ' CG2' ' A' ' 710' ' ' VAL . 23.8 t80 -61.07 -37.46 82.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -57.27 -50.86 71.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.919 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -61.38 -40.5 94.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.557 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 4.2 t80 -63.52 -40.93 98.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.908 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . 0.507 ' CG2' ' CE1' ' A' ' 706' ' ' PHE . 85.4 t -67.03 -53.61 32.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.153 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 13.6 mtpp -48.69 -53.55 18.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.852 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 1.1 p -61.27 -41.44 96.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.119 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.557 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 12.7 mmm180 -64.23 -25.79 68.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.869 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.09 179.912 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.197 0 CA-C-O 120.786 0.244 . . . . 0.0 112.359 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 41.2 tp -49.26 -49.21 44.48 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.897 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -51.83 -39.69 59.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.878 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -66.59 -70.29 0.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.116 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -44.05 -43.34 6.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.875 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.6 mtt -65.29 -40.32 93.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.86 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 17.3 mmmt -59.55 -41.41 90.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -65.16 -63.6 1.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.936 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.538 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 25.8 t80 -39.94 -57.2 1.66 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.861 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -54.64 -48.35 72.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.924 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -49.98 -35.39 24.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.848 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.427 ' O ' ' N ' ' A' ' 672' ' ' GLU . 4.7 mtm -71.84 -65.32 0.78 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.413 HD11 ' CE2' ' A' ' 666' ' ' PHE . 49.7 mt -36.83 -38.94 0.19 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.912 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 12.6 tp -75.51 -44.68 42.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . 0.427 ' N ' ' O ' ' A' ' 669' ' ' MET . 11.5 mm-40 -72.87 -64.55 0.94 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.892 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . 0.424 ' HA ' ' NE ' ' A' ' 673' ' ' ARG . 12.5 mmp_? -39.16 -35.68 0.25 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.847 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 98.66 28.67 7.78 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.46 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 38.0 t -59.43 91.78 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.847 0.356 . . . . 0.0 111.135 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 73.7 m -49.11 151.16 1.4 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.821 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -84.69 -48.11 9.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.127 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -56.36 -31.26 63.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.865 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -60.28 -178.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.889 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 10.9 t -104.45 -177.3 3.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.146 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.492 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 45.9 t-105 -83.05 -29.5 28.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.891 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -60.88 -60.79 3.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.881 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -54.15 -58.99 5.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.948 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -56.44 -42.51 78.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.895 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.492 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 7.7 tp -48.49 -54.92 12.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.985 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.493 ' C ' ' CD2' ' A' ' 686' ' ' HIS . 1.8 p-80 -63.67 -32.69 74.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 40.2 mttm -66.41 -23.22 66.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 22.4 pt -120.08 5.76 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.147 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 4.3 p -73.0 -25.24 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.117 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.577 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 13.1 p90 -76.25 -52.37 10.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.863 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.577 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.0 t70 -37.14 139.84 0.48 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.577 0.703 . . . . 0.0 110.862 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.5 Cg_endo -69.8 -36.49 10.61 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.631 2.22 . . . . 0.0 112.326 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.461 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 69.3 mtm180 -63.86 -19.44 65.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.53 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 27.7 t80 -66.07 -15.14 62.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.947 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 14.1 mt -101.47 3.71 40.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.897 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 80.3 mt -83.71 -49.58 8.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.885 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.447 ' CD1' ' HB2' ' A' ' 666' ' ' PHE . 30.7 mt -83.81 143.91 29.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -52.11 162.33 0.85 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.651 0.739 . . . . 0.0 110.873 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -35.42 12.59 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.674 2.249 . . . . 0.0 112.349 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 35.5 mttm -72.16 -46.3 56.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.877 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -59.7 -51.2 70.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.538 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 47.3 mtm180 -40.09 -46.92 2.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.908 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -68.15 -45.89 72.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.884 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -58.04 -58.47 8.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 97.6 t -55.06 -37.47 42.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.121 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -69.0 -32.13 71.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.844 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -68.58 -47.21 67.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.829 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -68.17 -36.89 80.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.945 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.468 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 3.7 t80 -66.26 -41.02 90.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.931 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 57.7 t -65.55 -45.51 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.138 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 6.8 ttmm -57.97 -51.24 70.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.903 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.7 p -61.39 -38.16 86.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.133 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.468 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 9.4 mmp_? -65.26 -33.65 76.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.888 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.15 179.864 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.163 0 CA-C-O 120.818 0.257 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 13.8 tp -57.88 -53.43 58.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -51.84 -35.52 44.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.904 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -64.86 -68.01 0.39 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.114 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 14.3 ptt180 -52.12 -41.72 62.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.885 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 663' ' ' MET . . . . . 0.441 ' CE ' ' OE1' ' A' ' 701' ' ' GLU . 6.7 mtt -61.76 -43.27 99.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . 0.427 ' HA ' ' CE ' ' A' ' 664' ' ' LYS . 0.4 OUTLIER -58.44 -41.66 85.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.928 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -61.23 -54.0 49.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.962 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.5 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 23.2 t80 -56.07 -45.19 79.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 6.0 ttpt -66.84 -36.47 82.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.919 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -60.33 -46.91 88.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.849 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.8 ptt? -69.2 -36.84 77.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 36.2 mt -56.4 -44.28 80.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.926 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 54.0 tp -76.34 -54.71 6.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.86 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.08 -61.9 1.95 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -48.07 -19.51 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.904 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 81.83 41.17 9.88 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.473 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 77.1 t -65.1 100.81 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.854 0.359 . . . . 0.0 111.151 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 58.2 m -52.22 148.07 6.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.873 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . 0.452 ' CA ' HG12 ' A' ' 710' ' ' VAL . . . -84.04 -39.34 19.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.126 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -82.69 43.91 0.87 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.8 m -130.86 -175.8 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.844 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 3.3 t -109.72 162.74 14.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.12 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.483 ' CH2' ' HB3' ' A' ' 702' ' ' ARG . 35.1 t-105 -65.37 -27.31 68.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.941 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -59.44 -60.17 4.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.924 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 22.6 mtpt -55.23 -59.0 5.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.913 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -54.8 -41.9 71.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.447 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 6.1 tp -50.66 -55.22 17.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.546 ' C ' ' CD2' ' A' ' 686' ' ' HIS . 1.1 p-80 -60.05 -35.03 74.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.844 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.544 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 22.2 mttp -67.53 -23.04 65.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.899 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 6.9 pt -116.73 6.47 7.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.072 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 9.0 p -70.93 -24.69 24.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.111 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.527 ' CD1' ' C ' ' A' ' 690' ' ' PHE . 2.4 p90 -87.98 -13.25 42.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.885 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.43 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.6 t70 -77.4 139.87 64.33 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.643 0.735 . . . . 0.0 110.824 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.43 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.0 Cg_endo -69.76 -34.16 15.13 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.684 2.256 . . . . 0.0 112.336 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.448 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 82.0 mtm180 -65.83 -16.1 63.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.858 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.432 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 33.0 t80 -70.0 -7.69 42.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.918 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 15.1 mt -118.13 12.14 13.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.907 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.448 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 90.6 mt -93.59 -23.26 18.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 30.8 mt -114.83 144.93 42.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -50.06 162.05 0.52 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.635 0.731 . . . . 0.0 110.9 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -31.1 21.07 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.659 2.239 . . . . 0.0 112.345 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 37.3 mtpt -72.16 -45.46 60.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.441 ' OE1' ' CE ' ' A' ' 663' ' ' MET . 18.8 mm-40 -60.12 -52.95 63.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.878 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.5 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 10.4 mtp180 -35.3 -48.64 0.47 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.839 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.27 -47.26 62.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.928 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -56.66 -60.77 3.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 94.2 t -55.31 -38.88 49.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.137 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -62.93 -37.26 86.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.851 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -64.76 -58.01 7.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.845 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 10.4 pt20 -53.87 -37.02 63.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.925 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.462 ' N ' ' HG3' ' A' ' 708' ' ' GLN . 2.6 t80 -63.87 -43.3 96.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . 0.452 HG12 ' CA ' ' A' ' 677' ' ' ALA . 69.6 t -67.65 -45.08 85.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.104 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -53.25 -48.96 67.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.903 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.99 -34.77 77.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.168 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -66.79 -24.44 66.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.901 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.071 179.928 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.846 0.269 . . . . 0.0 112.336 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . 0.4 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 15.7 tp -56.03 -48.08 76.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.927 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -54.69 -37.01 65.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -66.54 -69.78 0.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.05 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . 0.4 ' NE ' ' HA ' ' A' ' 659' ' ' LEU . 6.8 ptt180 -49.35 -45.39 45.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.91 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.5 mtt -60.87 -45.09 95.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 1.3 mmmm -55.05 -44.03 74.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -60.48 -62.08 2.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.939 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.57 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 20.9 t80 -49.12 -53.02 22.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 35.0 tttt -54.6 -45.6 73.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -51.71 -44.52 63.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.89 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.4 ' O ' ' C ' ' A' ' 670' ' ' LEU . 8.4 mtm -62.3 -63.35 1.26 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.906 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 669' ' ' MET . 49.2 mt -38.49 -40.69 0.59 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 54.8 tp -75.9 -56.12 4.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . 0.475 ' O ' ' N ' ' A' ' 674' ' ' GLY . 8.2 mm-40 -59.23 -65.74 0.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . 0.407 ' HA ' ' NE ' ' A' ' 673' ' ' ARG . 14.1 mmp_? -39.22 -26.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.854 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . 0.475 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 86.44 34.61 11.71 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.503 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . 0.454 ' CG1' ' HG3' ' A' ' 684' ' ' GLU . 76.7 t -60.29 99.07 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.868 0.366 . . . . 0.0 111.087 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 4.1 m -49.47 151.11 1.66 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -83.68 -26.69 29.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.103 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -102.01 48.12 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -123.97 -175.0 3.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.889 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 40.0 p -107.85 148.43 29.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.1 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.411 ' CZ2' HD11 ' A' ' 685' ' ' LEU . 31.2 t-105 -59.56 -29.13 67.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -63.73 -53.69 47.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.831 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . 0.506 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 10.8 mtpp -58.79 -59.06 6.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . 0.454 ' HG3' ' CG1' ' A' ' 675' ' ' VAL . 64.6 mm-40 -55.32 -37.02 66.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.411 HD11 ' CZ2' ' A' ' 681' ' ' TRP . 4.9 tp -54.53 -63.18 1.23 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.506 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 5.6 p-80 -56.86 -29.26 62.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.809 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -68.13 -32.08 72.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.932 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 11.2 pt -112.78 9.94 8.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.108 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 7.9 p -70.02 -24.66 26.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.131 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 10.4 p90 -80.08 -51.9 8.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.869 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.574 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 7.6 t70 -34.0 140.09 0.26 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.591 0.71 . . . . 0.0 110.904 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.43 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.67 -38.33 8.15 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.699 2.266 . . . . 0.0 112.357 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.46 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 28.7 mtm180 -65.56 -25.04 67.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.87 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.407 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 19.4 t80 -58.24 -11.59 2.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.897 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 30.9 mt -114.14 25.59 10.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.938 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.46 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 95.9 mt -109.52 -28.46 8.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.459 ' CD1' ' HB2' ' A' ' 666' ' ' PHE . 32.1 mt -103.21 139.37 38.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.971 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -48.5 162.62 0.35 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.598 0.713 . . . . 0.0 110.946 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -35.43 12.72 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.672 2.248 . . . . 0.0 112.348 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -72.15 -42.47 65.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.918 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 702' ' ' ARG . 26.4 mt-10 -60.0 -51.47 69.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.57 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 40.5 mtp180 -37.93 -51.04 1.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.871 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -66.09 -46.83 76.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.877 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -56.28 -61.06 2.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.882 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 84.6 t -56.19 -41.54 70.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.097 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -60.32 -44.08 95.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.908 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -58.12 -48.07 81.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.853 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -61.11 -45.18 95.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.917 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.508 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 5.5 t80 -55.92 -44.95 78.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 90.3 t -62.87 -51.91 65.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.134 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -45.98 -48.38 16.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.899 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.2 p -65.28 -46.54 80.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.145 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.508 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 12.5 mmp_? -59.22 -21.06 58.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.045 179.927 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo . . . . . 0 C--O 1.232 0.205 0 CA-C-O 120.818 0.258 . . . . 0.0 112.331 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 17.5 tp -57.81 -46.8 84.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -55.81 -32.17 63.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.92 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -70.84 -66.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.122 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -51.91 -48.84 63.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.913 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 9.1 mtt -57.52 -48.52 79.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.935 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -51.22 -44.71 61.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -59.24 -60.53 3.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.931 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -47.72 -59.9 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.88 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -46.24 -50.93 15.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.887 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -48.91 -48.14 42.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 3.8 mtm -56.37 -62.37 1.76 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.907 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 49.4 mt -41.23 -38.72 1.18 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 20.8 tp -72.52 -47.33 49.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.921 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . 0.425 ' O ' ' C ' ' A' ' 673' ' ' ARG . 12.3 mm-40 -71.69 -66.02 0.69 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.872 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 672' ' ' GLU . 13.2 mmt-85 -36.26 -39.26 0.17 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.875 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 100.01 29.61 6.75 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.531 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . 0.42 ' O ' ' C ' ' A' ' 676' ' ' SER . 19.4 t -59.57 87.54 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.877 0.37 . . . . 0.0 111.126 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 676' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 675' ' ' VAL . 50.8 m -37.15 155.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.861 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -100.11 -4.82 28.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.06 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -117.03 36.3 4.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.889 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.1 m -125.13 -177.02 3.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.841 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 2.8 p -94.14 153.52 18.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.156 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.56 ' CZ2' HD12 ' A' ' 685' ' ' LEU . 29.1 t-105 -63.09 -30.56 71.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.879 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.33 -57.17 13.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 9.2 mttp -56.2 -59.09 5.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . 0.509 ' OE1' ' CZ ' ' A' ' 706' ' ' PHE . 8.1 mt-10 -55.4 -43.75 75.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.918 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.56 HD12 ' CZ2' ' A' ' 681' ' ' TRP . 6.4 tp -47.35 -61.75 1.76 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.515 ' CD2' ' N ' ' A' ' 687' ' ' LYS . 1.8 p-80 -56.32 -35.36 67.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.859 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.515 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 13.4 mtmt -63.67 -25.47 68.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.867 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 13.7 pt -121.07 11.84 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.143 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 3.3 p -80.29 -34.68 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.11 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.448 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 4.8 p90 -67.15 -43.28 82.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.906 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.448 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.5 t70 -46.58 139.72 6.11 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.563 0.696 . . . . 0.0 110.848 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.1 Cg_endo -69.74 -42.0 3.81 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.705 2.27 . . . . 0.0 112.318 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 19.6 mtm-85 -56.71 -23.57 43.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.567 ' CE2' ' HD3' ' A' ' 702' ' ' ARG . 0.8 OUTLIER -65.72 -30.12 70.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.911 -179.859 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.417 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 35.7 mt -78.73 -6.46 55.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.889 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.88 -52.74 10.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.451 ' O ' ' NH2' ' A' ' 702' ' ' ARG . 11.7 mt -78.21 156.62 29.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -68.64 164.05 48.92 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.645 0.736 . . . . 0.0 110.857 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -35.41 12.73 Favored 'Trans proline' 0 N--CA 1.465 -0.176 0 C-N-CA 122.717 2.278 . . . . 0.0 112.38 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -72.44 -45.65 58.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.892 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.478 ' N ' ' CD ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -60.44 -53.47 57.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.567 ' HD3' ' CE2' ' A' ' 694' ' ' TYR . 68.7 mtt180 -34.49 -46.65 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.899 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 4.4 tmtm? -72.15 -46.23 57.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.841 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -56.26 -55.93 27.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.75 -48.41 81.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.158 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . 0.509 ' CZ ' ' OE1' ' A' ' 684' ' ' GLU . 19.2 t80 -55.43 -45.48 76.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.906 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -55.66 -47.7 76.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.845 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -64.53 -40.86 96.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.908 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.518 ' CZ ' ' HG3' ' A' ' 713' ' ' ARG . 11.7 t80 -63.95 -46.13 86.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.889 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . 0.482 ' CG2' ' CE1' ' A' ' 706' ' ' PHE . 68.9 t -63.71 -48.92 84.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.092 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -51.89 -45.52 64.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -41.07 69.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.147 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.518 ' HG3' ' CZ ' ' A' ' 709' ' ' TYR . 4.7 mmp_? -59.23 -33.32 70.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.908 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.095 179.931 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . 0.417 ' HG2' ' CB ' ' A' ' 661' ' ' ALA . 53.9 Cg_endo . . . . . 0 C--O 1.232 0.202 0 CA-C-O 120.852 0.271 . . . . 0.0 112.335 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 43.0 tp -59.42 -49.43 77.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -52.97 -36.58 60.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . 0.417 ' CB ' ' HG2' ' A' ' 658' ' ' PRO . . . -68.69 -69.49 0.32 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.119 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -47.72 -53.27 15.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 663' ' ' MET . . . . . 0.44 ' HA ' ' CD1' ' A' ' 697' ' ' LEU . 11.4 mtt -53.24 -44.4 68.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.933 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -31.87 70.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -67.45 -59.32 3.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.528 ' CD1' ' HE2' ' A' ' 669' ' ' MET . 26.5 t80 -55.03 -55.82 26.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.889 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.8 -44.31 73.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -52.15 -52.75 49.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.859 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.528 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 3.0 ptt? -67.73 -39.09 84.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.908 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 24.9 mt -47.52 -46.98 28.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.925 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.7 tp -79.62 -48.2 14.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . 0.433 ' O ' ' N ' ' A' ' 674' ' ' GLY . 27.9 mm-40 -55.6 -66.02 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.897 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 9.1 mmp_? -42.76 -23.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.872 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 87.33 43.99 5.72 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.485 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . 0.456 HG12 ' CG ' ' A' ' 684' ' ' GLU . 87.9 t -71.25 101.42 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.861 0.363 . . . . 0.0 111.18 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 3.2 t -61.35 154.93 22.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.891 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -87.3 -47.88 8.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.089 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -58.56 -27.06 64.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 39.2 m -65.96 167.55 9.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 30.3 p -92.29 163.34 13.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.14 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 4.4 t-105 -67.31 -31.5 71.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.923 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -58.83 -56.9 16.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.846 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -56.52 -59.03 5.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.934 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . 0.456 ' CG ' HG12 ' A' ' 675' ' ' VAL . 63.1 mm-40 -53.94 -40.68 67.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 5.7 tp -52.09 -59.12 4.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.932 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.521 ' CD2' ' N ' ' A' ' 687' ' ' LYS . 1.6 p-80 -56.49 -33.31 65.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.83 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 48.0 mttt -65.56 -31.7 72.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 12.5 pt -112.83 11.07 8.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.11 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 4.3 p -76.69 -32.9 21.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.171 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -74.99 -28.66 60.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.879 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.429 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 11.6 t70 -63.4 139.81 97.63 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.585 0.707 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.2 Cg_endo -69.77 -40.63 5.08 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.703 2.269 . . . . 0.0 112.324 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 36.7 mtm180 -57.99 -22.14 48.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.834 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.637 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 11.6 t80 -67.13 -3.56 7.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.94 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 28.2 mt -111.49 -13.95 13.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.904 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.56 -46.05 90.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.928 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.44 ' CD1' ' HA ' ' A' ' 663' ' ' MET . 30.1 mt -93.68 140.54 29.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -48.87 162.81 0.36 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.599 0.714 . . . . 0.0 110.924 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . 0.444 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.6 Cg_endo -69.76 -32.18 19.07 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.738 2.292 . . . . 0.0 112.338 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -72.23 -46.92 54.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.861 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.0 -49.84 75.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.879 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.637 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 56.8 mtm180 -42.66 -43.5 3.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.87 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -71.2 -42.86 68.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.903 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -60.4 -57.31 13.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 74.5 t -56.91 -43.69 80.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.118 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . 0.412 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 20.9 t80 -61.74 -43.39 98.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.891 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -55.59 -49.0 73.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -63.47 -38.05 89.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.593 ' C ' ' CD1' ' A' ' 709' ' ' TYR . 0.3 OUTLIER -66.69 -38.15 86.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.927 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . 0.412 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 99.4 t -72.98 -53.7 17.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.137 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -49.42 -51.61 34.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.888 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 10.6 p -66.25 -36.56 83.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.15 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.56 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 9.9 mmm180 -66.02 -34.35 77.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.884 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.082 179.92 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . 0.445 ' O ' ' N ' ' A' ' 661' ' ' ALA . 54.1 Cg_endo . . . . . 0 C--O 1.232 0.196 0 CA-C-O 120.802 0.251 . . . . 0.0 112.345 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 21.4 tp -44.25 -36.56 2.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.933 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -71.24 -31.72 67.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.882 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . 0.445 ' N ' ' O ' ' A' ' 658' ' ' PRO . . . -66.25 -55.79 14.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.121 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . 0.459 ' HB2' ' CD2' ' A' ' 697' ' ' LEU . 0.0 OUTLIER -60.22 -54.87 40.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.869 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 16.1 mtt -51.05 -47.6 61.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.887 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.54 -45.43 73.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.921 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -59.69 -50.63 73.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.898 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.446 ' O ' ' CG ' ' A' ' 669' ' ' MET . 30.9 t80 -57.74 -58.98 5.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -51.14 -37.69 47.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.891 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -58.24 -52.52 65.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.852 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.456 ' HB3' ' CZ ' ' A' ' 693' ' ' ARG . 2.8 ptt? -67.31 -35.82 80.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.909 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 20.0 mt -52.45 -52.56 53.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.93 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 13.2 tp -78.09 -43.16 29.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -55.31 -65.63 0.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.903 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 10.2 mmp_? -45.86 -26.14 0.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 92.12 38.36 5.72 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.518 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 42.0 t -61.06 112.47 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 111.17 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 16.1 m -70.22 127.51 33.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.878 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -67.97 -53.35 26.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.124 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -51.59 -32.32 28.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.934 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.3 m -62.08 -178.69 0.17 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.804 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 16.9 p -102.5 167.31 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.104 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.464 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 32.6 t-105 -66.9 -24.75 66.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.913 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -64.0 -63.12 1.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.916 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.01 -58.97 4.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -56.67 -44.63 81.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.866 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.464 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.4 tp -48.22 -50.49 29.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.982 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.577 ' CD2' ' N ' ' A' ' 687' ' ' LYS . 1.2 p-80 -65.9 -33.87 76.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.577 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 51.7 mttt -65.94 -23.6 66.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.832 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 7.2 pt -117.8 3.17 7.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.182 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 7.9 p -68.2 -33.13 58.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.099 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -84.26 5.29 27.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.876 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.488 ' OD1' ' N ' ' A' ' 693' ' ' ARG . 4.7 t70 -92.72 142.63 25.91 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.625 0.726 . . . . 0.0 110.862 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.9 Cg_endo -69.72 -47.84 0.86 Allowed 'Trans proline' 0 N--CA 1.465 -0.197 0 C-N-CA 122.705 2.27 . . . . 0.0 112.385 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.488 ' N ' ' OD1' ' A' ' 691' ' ' ASP . 79.1 mtm180 -53.07 -25.29 12.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.469 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 19.6 t80 -65.66 -5.23 7.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.923 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 30.8 mt -118.05 10.95 13.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.905 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.434 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 94.1 mt -94.12 -31.79 14.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.459 ' CD2' ' HB2' ' A' ' 662' ' ' ARG . 40.1 mt -102.56 141.09 35.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.969 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 -47.5 162.36 0.3 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.667 0.746 . . . . 0.0 110.853 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . 0.402 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.0 Cg_endo -69.72 -34.16 15.27 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.651 2.234 . . . . 0.0 112.374 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -72.27 -44.56 62.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.461 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -62.02 -49.64 75.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.432 ' NH1' ' O ' ' A' ' 694' ' ' TYR . 43.3 mtm180 -42.7 -44.69 4.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.903 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 7.7 tppt? -69.3 -46.33 67.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -57.03 -55.07 39.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.881 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.6 t -58.68 -37.47 65.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.105 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -67.27 -34.6 77.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -64.7 -54.22 34.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.883 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . 0.461 ' CG ' ' N ' ' A' ' 709' ' ' TYR . 7.6 pt20 -57.84 -45.38 86.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.941 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.693 ' CD2' ' CZ ' ' A' ' 713' ' ' ARG . 2.7 t80 -56.99 -52.71 64.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.922 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 92.3 t -59.66 -39.23 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.168 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -53.54 -51.25 63.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.967 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 712' ' ' THR . . . . . 0.436 ' O ' ' N ' ' A' ' 714' ' ' ALA . 20.3 p -70.03 -67.12 0.51 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.156 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.693 ' CZ ' ' CD2' ' A' ' 709' ' ' TYR . 10.4 mpt_? -42.34 -23.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.869 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 712' ' ' THR . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.1 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . 0.403 ' HG2' ' CB ' ' A' ' 661' ' ' ALA . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.167 0 CA-C-O 120.879 0.283 . . . . 0.0 112.3 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 25.6 tp -56.07 -47.29 78.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . 0.432 ' HG3' ' N ' ' A' ' 661' ' ' ALA . 8.1 pt-20 -56.35 -36.0 68.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . 0.432 ' N ' ' HG3' ' A' ' 660' ' ' GLU . . . -68.39 -71.04 0.23 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.105 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -46.92 -48.96 21.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.839 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.4 mtt -55.25 -49.09 72.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.859 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.71 -48.23 50.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.939 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -56.7 -61.21 2.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.901 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . 0.55 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 21.2 t80 -43.53 -60.62 1.67 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -51.04 -47.71 61.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.902 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -50.18 -41.15 48.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.915 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 4.4 mtm -65.4 -63.42 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.864 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 57.3 mt -39.38 -40.11 0.76 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.919 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 19.8 tp -76.64 -45.9 28.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.928 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -65.22 -62.77 1.34 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -46.23 -21.81 0.19 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.898 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 84.29 42.68 7.36 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.506 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 37.3 t -70.01 100.61 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.837 0.351 . . . . 0.0 111.115 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 20.3 m -56.2 141.22 41.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.843 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -77.85 -37.87 47.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.07 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -81.47 44.92 0.83 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.902 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.7 m -133.67 -177.2 4.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.896 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 5.2 t -99.1 154.14 18.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.154 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.48 ' CZ2' HD11 ' A' ' 685' ' ' LEU . 3.3 t-105 -65.47 -32.63 74.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -57.97 -48.89 78.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.918 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 32.4 mttm -62.85 -59.02 5.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.909 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -55.76 -37.3 68.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.48 HD11 ' CZ2' ' A' ' 681' ' ' TRP . 8.0 tp -56.58 -62.94 1.38 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.919 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.582 ' CD2' ' N ' ' A' ' 687' ' ' LYS . 2.1 p-80 -51.72 -36.01 45.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.582 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 37.5 mttm -64.26 -33.47 75.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.918 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 23.9 pt -108.09 10.06 9.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.092 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 3.3 p -78.17 -11.71 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.115 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.424 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 11.4 p90 -90.49 -41.61 11.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.879 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.424 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 10.6 t70 -53.59 139.8 48.77 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.595 0.712 . . . . 0.0 110.875 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.8 Cg_endo -69.76 -42.49 3.35 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.659 2.239 . . . . 0.0 112.372 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.452 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 22.4 mtm-85 -53.41 -20.66 4.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.897 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.576 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 40.3 t80 -63.3 -25.56 68.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.884 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 28.6 mt -85.73 -20.26 29.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.944 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.452 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 78.8 mt -59.27 -47.65 84.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.967 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.449 HD12 ' CB ' ' A' ' 666' ' ' PHE . 10.8 mt -85.18 145.1 27.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.884 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -60.55 164.16 7.65 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.646 0.736 . . . . 0.0 110.861 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.67 -34.05 15.66 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.642 2.228 . . . . 0.0 112.394 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -72.38 -47.03 52.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.414 ' O ' ' C ' ' A' ' 702' ' ' ARG . 6.0 mm-40 -61.46 -54.17 46.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.821 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.576 ' NH1' ' CE2' ' A' ' 694' ' ' TYR . 30.6 mtm180 -37.1 -45.04 0.58 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.924 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 3.2 tppt? -70.27 -45.8 65.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.924 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -60.84 -58.98 6.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.887 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 44.1 t -50.68 -52.54 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.146 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . 0.416 ' CZ ' HG22 ' A' ' 710' ' ' VAL . 20.2 t80 -51.1 -55.14 19.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.858 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -45.49 -51.18 12.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -60.63 -44.42 96.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.939 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.459 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 1.5 t80 -56.97 -42.63 80.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.951 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . 0.416 HG22 ' CZ ' ' A' ' 706' ' ' PHE . 85.0 t -66.3 -39.3 83.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.137 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 46.9 tttt -58.82 -41.34 86.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.87 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.8 p -73.74 -41.68 62.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.469 ' HA ' ' CZ ' ' A' ' 713' ' ' ARG . 0.1 OUTLIER -66.3 -27.0 67.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.861 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.102 179.949 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--O 1.232 0.204 0 CA-C-O 120.796 0.248 . . . . 0.0 112.33 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 36.2 tp -53.48 -47.35 69.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.912 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 660' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 1.5 mp0 -56.53 -34.2 66.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.874 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.97 -67.93 0.43 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.046 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -48.62 -55.69 10.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.921 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.9 mtt -54.15 -47.18 72.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.867 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 664' ' ' LYS . . . . . 0.439 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 11.7 mmmt -51.18 -48.88 61.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.869 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -56.44 -60.72 3.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.933 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 666' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -46.41 -62.01 1.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 57.5 tttt -47.55 -49.18 27.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.914 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -47.62 -49.63 26.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.867 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 669' ' ' MET . . . . . 0.454 ' O ' ' N ' ' A' ' 672' ' ' GLU . 4.6 mtm -59.07 -64.51 0.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.849 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 670' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 669' ' ' MET . 50.4 mt -37.54 -41.7 0.48 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.916 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 23.4 tp -76.8 -38.76 53.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.909 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 672' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' A' ' 669' ' ' MET . 5.7 mm-40 -73.29 -65.98 0.74 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.888 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 673' ' ' ARG . . . . . 0.433 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 5.4 mmp_? -39.63 -33.91 0.21 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.837 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 97.89 25.09 10.87 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.48 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 675' ' ' VAL . . . . . 0.423 HG12 ' CD ' ' A' ' 684' ' ' GLU . 39.8 t -51.82 97.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.84 0.353 . . . . 0.0 111.103 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 43.4 m -54.75 132.14 45.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -64.95 -47.55 77.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.098 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -76.85 48.02 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.867 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.3 t -130.84 176.61 8.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.901 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 61.1 p -94.51 142.1 27.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.107 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 681' ' ' TRP . . . . . 0.512 ' CE3' ' CD2' ' A' ' 706' ' ' PHE . 34.9 t-105 -57.12 -31.65 65.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.964 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -60.32 -56.01 26.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.881 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 683' ' ' LYS . . . . . 0.54 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 44.6 mttt -57.99 -59.01 5.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.908 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 684' ' ' GLU . . . . . 0.423 ' CD ' HG12 ' A' ' 675' ' ' VAL . 21.6 mm-40 -56.04 -41.04 74.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.898 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 685' ' ' LEU . . . . . 0.436 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 9.4 tp -50.63 -58.88 4.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.935 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 686' ' ' HIS . . . . . 0.54 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 3.8 p-80 -60.62 -29.96 69.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.86 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 687' ' ' LYS . . . . . 0.418 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 66.4 mttt -67.03 -27.59 67.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.943 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 13.1 pt -117.97 8.3 6.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.104 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 4.0 p -74.84 -28.36 21.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.157 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 690' ' ' PHE . . . . . 0.465 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 13.6 p90 -73.49 -44.53 57.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.845 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 691' ' ' ASP . . . . . 0.465 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.8 t70 -40.82 139.77 1.14 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.627 0.727 . . . . 0.0 110.861 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.77 -39.17 6.8 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.679 2.253 . . . . 0.0 112.339 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 693' ' ' ARG . . . . . 0.467 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 79.4 mtm180 -61.36 -27.19 68.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.809 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 694' ' ' TYR . . . . . 0.519 ' CD1' ' C ' ' A' ' 694' ' ' TYR . 1.4 t80 -62.7 -23.62 67.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.923 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.407 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 20.2 mt -91.17 9.26 31.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.953 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 696' ' ' LEU . . . . . 0.467 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 89.6 mt -89.77 -40.84 12.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 697' ' ' LEU . . . . . 0.449 ' O ' ' NH2' ' A' ' 702' ' ' ARG . 60.7 mt -91.97 166.0 12.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.894 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 698' ' ' ASN . . . . . 0.503 ' ND2' ' OE2' ' A' ' 701' ' ' GLU . 0.2 OUTLIER -78.58 165.39 50.1 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.623 0.725 . . . . 0.0 110.89 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -26.11 27.88 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.725 2.283 . . . . 0.0 112.353 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -72.47 -47.8 45.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.915 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 701' ' ' GLU . . . . . 0.503 ' OE2' ' ND2' ' A' ' 698' ' ' ASN . 0.0 OUTLIER -66.17 -52.75 45.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.887 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 702' ' ' ARG . . . . . 0.449 ' NH2' ' O ' ' A' ' 697' ' ' LEU . 79.8 mtt180 -35.13 -44.66 0.26 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.874 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 19.3 tptp -74.48 -48.76 25.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -55.81 -57.73 10.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.94 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 89.9 t -56.71 -49.86 76.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.112 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 706' ' ' PHE . . . . . 0.512 ' CD2' ' CE3' ' A' ' 681' ' ' TRP . 20.1 t80 -53.22 -41.15 65.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.85 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.37 -46.19 91.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.866 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -61.03 -39.86 91.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.916 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 709' ' ' TYR . . . . . 0.447 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 22.7 t80 -63.06 -43.25 99.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.917 -179.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 86.8 t -63.49 -48.93 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.087 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 35.9 tttt -54.11 -48.54 70.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 2.3 p -66.58 -37.25 84.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.159 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 713' ' ' ARG . . . . . 0.447 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.2 mmm180 -66.54 -28.24 68.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.156 179.892 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 N-CA-C 112.454 -0.259 . . . . 0.0 112.454 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 2.0 m 44.87 42.27 5.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.881 0.372 . . . . 0.0 110.845 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 35.5 t -89.72 136.93 32.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 77.0 101.6 0.16 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.47 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 60.3 p -45.09 119.98 2.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.882 0.373 . . . . 0.0 110.891 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 38.3 m -46.7 -50.73 17.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.864 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . 0.413 ' O ' ' C ' ' A' ' 651' ' ' ALA . . . 158.2 46.51 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.442 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . 0.413 ' C ' ' O ' ' A' ' 650' ' ' GLY . . . -36.91 112.79 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 0.0 111.122 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -56.92 -32.58 66.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -104.02 176.95 4.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.911 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -80.91 -64.01 1.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.915 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -122.0 25.24 9.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.108 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 94.6 mt -121.67 112.7 36.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.13 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 6.2 m -52.46 144.16 24.69 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.617 0.722 . . . . 0.0 111.141 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 163.08 39.57 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.686 2.257 . . . . 0.0 112.347 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 14.8 tp -56.02 -47.3 78.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -58.01 -33.69 69.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.867 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.45 -67.17 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.104 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . 0.459 ' CG ' HD22 ' A' ' 697' ' ' LEU . 14.9 ptt180 -53.82 -47.22 71.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.849 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.3 mtt -54.99 -41.35 71.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -61.58 -43.48 98.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -57.47 -57.89 10.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.951 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.55 ' CE1' ' CE ' ' A' ' 669' ' ' MET . 25.1 t80 -51.99 -52.49 50.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.898 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 12.4 ttmt -55.89 -37.21 68.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.905 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.86 -52.16 66.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.838 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.55 ' CE ' ' CE1' ' A' ' 666' ' ' PHE . 2.8 ptt? -66.92 -37.46 84.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 29.6 mt -52.25 -48.86 64.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.938 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.8 tp -77.5 -45.75 24.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -57.1 -66.04 0.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 10.4 mmp_? -43.76 -25.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.872 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 89.2 43.84 5.19 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.515 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 40.4 t -68.06 97.87 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.853 0.359 . . . . 0.0 111.128 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 8.7 t -51.42 143.92 10.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.815 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -80.89 -42.08 22.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.133 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -82.94 47.67 1.25 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.885 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.8 m -131.9 -178.62 4.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.856 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 1.7 t -101.7 151.45 22.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.125 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.407 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 26.1 t-105 -59.43 -25.59 64.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.957 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.58 -56.64 14.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.904 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . 0.424 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 38.4 mttp -56.13 -59.04 5.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.882 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 37.7 mm-40 -54.92 -40.6 70.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.908 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.407 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 11.7 tp -51.77 -59.41 4.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.883 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.444 ' CD2' ' C ' ' A' ' 686' ' ' HIS . 3.1 p-80 -59.2 -29.81 67.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.475 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 45.9 mttm -68.03 -28.12 67.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.849 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 25.3 pt -117.88 10.45 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.113 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 4.7 p -74.4 -37.6 45.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.091 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.475 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 7.2 p90 -80.5 9.41 6.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.868 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.421 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 10.0 t70 -93.68 139.81 22.88 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.595 0.712 . . . . 0.0 110.858 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.421 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.9 Cg_endo -69.8 -43.06 2.85 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.671 2.247 . . . . 0.0 112.358 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.469 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 70.9 mtm180 -58.47 -21.66 52.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.644 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 1.8 t80 -67.04 -18.69 65.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 12.2 mt -97.29 7.26 46.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.469 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 83.4 mt -91.13 -31.2 16.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.459 HD22 ' CG ' ' A' ' 662' ' ' ARG . 27.2 mt -104.12 152.39 22.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.894 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -57.31 161.86 4.99 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.693 0.758 . . . . 0.0 110.887 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 -37.23 9.52 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.696 2.264 . . . . 0.0 112.362 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -72.1 -45.52 60.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' A' ' 702' ' ' ARG . 36.9 mt-10 -56.95 -53.15 61.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.899 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.644 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 47.5 mtt180 -36.28 -52.24 0.8 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.837 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -65.38 -45.07 85.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -56.35 -57.89 10.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.04 -29.98 42.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.109 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -71.08 -47.95 55.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -55.89 -52.64 63.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.881 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -60.33 -41.8 94.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.893 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -58.99 -41.22 87.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.858 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 78.2 t -68.95 -43.04 82.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.067 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -53.23 -51.25 62.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.894 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 47.3 p -66.74 -35.73 80.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.149 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.407 ' HA ' ' NE ' ' A' ' 713' ' ' ARG . 5.0 mmp_? -66.45 -29.47 69.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -83.2 -46.45 12.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.14 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . 0.408 ' O ' ' N ' ' A' ' 717' ' ' GLU . 4.5 pt-20 -57.72 -41.98 82.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.871 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -41.1 -27.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.886 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . 0.454 ' O ' ' C ' ' A' ' 718' ' ' ARG . 8.9 tt0 -57.99 -51.39 69.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.842 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . 0.454 ' C ' ' O ' ' A' ' 717' ' ' GLU . 5.4 ttt180 -34.28 -41.52 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.859 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -67.15 145.14 55.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.919 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 79.3 p -40.06 -49.56 2.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.885 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 149.25 174.86 21.12 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.502 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -4.79 14.74 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.704 2.269 . . . . 0.0 112.36 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 41.3 p -52.82 137.8 31.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 4.6 p -137.35 129.52 29.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.906 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.263 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.459 -179.942 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 112.536 -0.226 . . . . 0.0 112.536 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 70.4 m -156.83 148.82 22.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.859 0.362 . . . . 0.0 110.832 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 53.8 p -139.82 173.11 11.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.822 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 161.44 111.57 0.27 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.509 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 3.1 t -158.12 116.14 3.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.893 0.378 . . . . 0.0 110.879 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 66.5 m -78.48 137.05 37.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.88 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -171.53 53.65 0.18 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.487 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -138.07 122.97 18.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.788 0.328 . . . . 0.0 111.086 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -58.82 -47.68 83.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.852 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -69.25 85.2 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . 0.45 ' HB2' ' CZ ' ' A' ' 654' ' ' ARG . 3.4 ptm85 -58.73 147.37 33.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.867 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -88.57 151.99 22.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 36.7 mm -120.16 106.16 18.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.154 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 3.2 m -63.77 153.94 82.3 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.653 0.74 . . . . 0.0 111.105 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 155.33 66.14 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.637 2.225 . . . . 0.0 112.335 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 26.4 tp -46.22 -47.58 17.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.933 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -57.65 -35.68 70.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.909 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.68 -70.46 0.26 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.104 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . 0.408 ' HG3' ' CD2' ' A' ' 697' ' ' LEU . 5.2 ptm180 -46.8 -51.63 16.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.885 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.1 mtt -56.97 -50.1 73.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.87 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -51.25 -41.83 60.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.899 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -61.49 -65.45 0.69 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.912 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.407 ' HB2' ' CD1' ' A' ' 697' ' ' LEU . 21.6 t80 -44.81 -49.12 10.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 43.7 tttt -63.22 -42.26 99.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -52.83 -36.39 58.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.402 ' HG2' ' NH1' ' A' ' 693' ' ' ARG . 6.3 mtm -73.81 -60.54 2.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 54.3 mt -39.23 -42.32 0.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.948 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.2 tp -78.46 -50.45 11.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.918 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -59.73 -65.91 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.858 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -41.83 -32.84 0.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.896 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 96.24 31.4 7.24 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.489 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 69.6 t -55.11 103.44 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.874 0.368 . . . . 0.0 111.116 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 59.3 m -59.3 137.51 57.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -72.96 1.6 8.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.092 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -121.86 24.02 9.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.88 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.6 t -105.72 161.95 13.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.839 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 11.5 p -88.66 147.8 24.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.172 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.492 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 56.1 t-105 -50.98 -28.07 9.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.9 -61.74 2.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.896 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . 0.559 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 0.6 OUTLIER -54.54 -59.06 5.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . 0.413 ' OE1' ' CZ ' ' A' ' 706' ' ' PHE . 9.0 mt-10 -54.8 -41.05 70.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.916 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.492 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 8.1 tp -52.43 -68.59 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.559 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 4.4 p-80 -50.18 -31.64 14.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.861 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 45.6 mttt -68.35 -28.29 67.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 24.3 pt -119.15 15.48 6.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.14 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . 0.409 ' CG1' ' N ' ' A' ' 690' ' ' PHE . 3.2 p -83.85 -39.36 14.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.141 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.409 ' N ' ' CG1' ' A' ' 689' ' ' VAL . 15.4 p90 -68.24 -20.93 64.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.868 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.413 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.6 t70 -72.11 139.75 82.47 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.619 0.723 . . . . 0.0 110.873 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.413 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.77 -38.74 7.36 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.681 2.254 . . . . 0.0 112.367 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.461 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 59.4 mtm180 -53.84 -27.49 30.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.868 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.644 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 15.7 t80 -63.0 -23.41 67.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.93 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 17.4 mt -100.75 18.03 20.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.95 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 74.2 mt -99.93 -41.53 7.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.909 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.408 ' CD2' ' HG3' ' A' ' 662' ' ' ARG . 29.2 mt -89.67 146.51 24.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.904 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 9.6 m-20 -47.09 161.47 0.3 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.627 0.727 . . . . 0.0 110.895 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -37.04 9.83 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.698 2.265 . . . . 0.0 112.34 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.02 -37.69 69.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.948 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.437 ' O ' ' C ' ' A' ' 702' ' ' ARG . 8.3 mt-10 -62.53 -55.3 28.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.879 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.644 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 50.1 mtm180 -34.5 -47.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.862 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 9.4 tppt? -71.2 -46.95 60.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.885 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -57.88 -59.98 4.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.901 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 96.1 t -52.62 -50.72 39.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.13 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . 0.413 ' CZ ' ' OE1' ' A' ' 684' ' ' GLU . 20.9 t80 -49.11 -46.06 44.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.898 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -57.8 -54.78 43.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.881 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -52.84 -47.3 67.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.895 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.517 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 12.3 t80 -52.53 -51.03 61.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.951 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 41.1 t -58.02 -50.7 77.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.115 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -44.69 -56.42 4.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.908 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 39.7 p -60.35 -47.33 86.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.116 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.517 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.1 mmm180 -54.72 -21.73 11.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -85.59 -54.36 4.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.054 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -52.28 -36.12 52.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.908 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -84.63 22.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.916 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -64.48 104.0 0.73 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.923 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -67.9 156.56 36.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.906 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -86.8 -58.35 2.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.843 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 37.8 t -100.92 41.73 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.842 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -99.81 177.94 29.46 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.494 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 93.23 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.682 2.255 . . . . 0.0 112.334 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 63.8 m -147.73 152.91 38.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 89.6 p -64.57 111.17 2.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.832 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.5 -179.999 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.308 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 81.3 p -81.87 112.06 18.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.909 0.385 . . . . 0.0 110.873 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 31.0 t -57.44 -48.71 78.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.812 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 109.03 -72.03 0.2 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.481 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 84.8 p -114.77 109.53 18.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.858 0.361 . . . . 0.0 110.863 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 35.2 t -124.24 107.56 11.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.79 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -149.41 101.3 0.22 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.486 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -104.73 79.67 1.56 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.805 0.336 . . . . 0.0 111.118 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -109.44 174.28 5.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -85.76 -59.09 2.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.925 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -127.94 121.73 30.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -134.03 118.03 17.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.065 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 73.6 mt -79.93 96.42 2.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.138 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . 0.402 HG23 ' N ' ' A' ' 658' ' ' PRO . 5.4 p -47.96 134.68 11.51 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.605 0.717 . . . . 0.0 111.138 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . 0.411 ' HG2' ' CB ' ' A' ' 661' ' ' ALA . 53.5 Cg_endo -69.8 156.69 62.61 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.67 2.247 . . . . 0.0 112.329 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 17.7 tp -58.78 -50.72 72.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . 0.47 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 6.0 tp10 -51.26 -34.43 32.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . 0.411 ' CB ' ' HG2' ' A' ' 658' ' ' PRO . . . -70.62 -71.07 0.26 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.085 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -48.01 -49.79 29.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.864 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.9 mtt -55.91 -45.7 78.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.878 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . 0.47 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 8.5 mmmt -55.83 -42.26 75.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.4 -56.52 21.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.571 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 25.8 t80 -50.15 -49.71 51.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 33.8 tttt -62.16 -36.71 82.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -45.21 92.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.866 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.459 ' CG ' ' O ' ' A' ' 666' ' ' PHE . 3.0 ptt? -72.26 -38.67 68.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.9 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 25.3 mt -52.17 -47.49 65.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.954 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 22.0 tp -77.02 -50.36 13.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.94 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -53.19 -66.05 0.45 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.885 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -43.95 -31.36 0.87 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.874 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 96.25 45.9 2.7 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.502 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 74.7 t -72.4 89.57 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.857 0.36 . . . . 0.0 111.12 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 41.9 m -56.83 123.84 16.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.871 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -56.62 -31.8 64.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.072 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -70.0 -22.88 63.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.871 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 24.5 t -67.1 173.62 3.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.845 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 25.2 p -104.42 158.21 16.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.165 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.461 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 44.9 t-105 -59.87 -33.19 71.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -60.97 -58.6 7.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.92 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . 0.478 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 63.6 mttt -57.15 -59.06 5.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.843 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -55.5 -38.28 68.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.853 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.461 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 5.1 tp -53.5 -52.95 57.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.933 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.478 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 3.0 p-80 -65.52 -29.12 69.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 61.7 mttt -68.72 -33.28 73.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.949 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . 0.42 HD11 ' CE ' ' A' ' 669' ' ' MET . 7.5 pt -111.04 6.91 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.137 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 8.0 p -66.03 -25.07 35.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.14 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.514 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 9.1 p90 -85.52 -47.15 10.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.514 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.4 t70 -34.28 142.05 0.23 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.626 0.727 . . . . 0.0 110.829 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.418 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.76 -39.32 6.66 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.715 2.276 . . . . 0.0 112.358 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.499 ' N ' ' OD1' ' A' ' 691' ' ' ASP . 11.9 mtm-85 -67.19 -21.58 65.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.859 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.417 ' CB ' ' O ' ' A' ' 688' ' ' ILE . 18.8 t80 -63.96 -18.77 64.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 18.9 mt -109.9 23.53 14.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.948 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.469 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 81.3 mt -105.12 -25.6 12.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.907 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 27.9 mt -110.5 144.56 39.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.895 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -50.75 163.12 0.5 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.584 0.707 . . . . 0.0 110.893 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -31.7 20.02 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.706 2.271 . . . . 0.0 112.299 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -45.04 61.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.902 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 5.5 mm-40 -59.07 -54.53 46.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.907 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.571 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 38.1 mtp180 -34.28 -50.43 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -68.0 -45.67 73.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . 0.409 ' N ' ' O ' ' A' ' 701' ' ' GLU . 10.9 mm-40 -58.23 -60.32 3.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.913 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.4 t -54.71 -46.63 73.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.167 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . 0.474 ' CE1' ' CG2' ' A' ' 710' ' ' VAL . 25.2 t80 -60.76 -41.4 95.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.907 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -54.92 -53.03 60.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.833 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -61.64 -39.04 89.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.929 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -63.99 -39.07 93.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.937 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . 0.474 ' CG2' ' CE1' ' A' ' 706' ' ' PHE . 86.6 t -69.6 -53.92 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.114 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 12.8 mtpp -48.14 -48.47 34.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 45.3 p -66.85 -38.95 87.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 12.6 mmt-85 -62.19 -47.16 85.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -74.29 -54.56 7.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.104 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -51.1 -28.25 10.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.905 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -96.46 27.76 3.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.921 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.16 119.79 4.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.894 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . 0.469 ' HB2' ' CZ ' ' A' ' 718' ' ' ARG . 12.1 mtm105 -111.53 96.19 5.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . 0.434 ' NE ' ' HA ' ' A' ' 719' ' ' ARG . 11.3 mmp_? -70.31 172.95 7.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.845 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 11.1 p -90.12 148.46 22.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.829 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -124.19 -94.92 1.1 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.476 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 -7.31 20.74 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.679 2.253 . . . . 0.0 112.299 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 27.1 m -99.11 142.38 30.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.886 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 3.5 m -156.09 159.67 39.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.857 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.505 -179.974 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 49.4 m -130.89 82.11 2.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.853 0.359 . . . . 0.0 110.908 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 2.5 t -38.34 104.97 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.865 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 128.73 127.38 2.96 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.508 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 23.3 m -144.31 171.23 14.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.899 0.38 . . . . 0.0 110.85 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 23.2 t 52.2 43.69 30.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.851 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -149.32 151.79 23.87 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.46 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -43.0 101.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.764 0.316 . . . . 0.0 111.086 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 60.4 mtt-85 -89.65 154.18 20.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.863 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.3 131.43 42.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.889 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 13.3 mtp85 -129.87 -53.23 1.14 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.907 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -118.06 50.78 1.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.087 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 8.0 mm -132.98 95.43 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.133 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . 0.432 ' CG1' ' O ' ' A' ' 657' ' ' VAL . 12.2 p -101.28 98.35 8.86 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.664 0.745 . . . . 0.0 111.12 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 156.44 63.24 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.684 2.256 . . . . 0.0 112.323 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 21.9 tp -59.99 -48.82 80.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -51.95 -32.76 34.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.855 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -74.0 -68.83 0.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.087 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -48.7 -48.36 40.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.891 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 9.2 mtt -59.05 -51.26 70.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -50.39 -39.37 46.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -63.24 -58.16 8.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.862 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.565 ' CE2' ' HG2' ' A' ' 702' ' ' ARG . 23.2 t80 -51.9 -43.95 63.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.897 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 34.0 tttp -69.7 -39.25 77.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.859 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -57.67 -43.32 84.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.871 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -71.99 -37.95 69.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.892 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 27.1 mt -53.86 -46.54 71.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 42.9 tp -75.46 -51.28 13.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.953 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -54.85 -63.62 1.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 12.7 mmp_? -45.78 -24.29 0.36 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.881 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 86.44 44.42 5.87 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.527 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 54.9 t -70.11 107.81 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.812 0.339 . . . . 0.0 111.162 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 39.1 m -63.36 149.87 44.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -81.4 -52.94 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.131 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -57.79 -13.55 4.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.892 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -75.03 172.37 12.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.862 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 2.4 t -105.25 165.14 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.186 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.531 ' CZ2' HD11 ' A' ' 685' ' ' LEU . 40.6 t-105 -62.73 -26.52 68.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -61.47 -62.11 2.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . 0.405 ' O ' ' ND1' ' A' ' 686' ' ' HIS . 39.8 mttp -53.52 -58.94 5.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.914 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 46.7 mm-40 -55.48 -45.79 76.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.903 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.531 HD11 ' CZ2' ' A' ' 681' ' ' TRP . 6.7 tp -45.59 -55.11 6.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.906 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.486 ' C ' ' CD2' ' A' ' 686' ' ' HIS . 1.7 p-80 -64.13 -31.63 72.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.856 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.552 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 56.9 mttm -68.97 -22.84 64.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 8.7 pt -118.48 5.0 6.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.119 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 7.9 p -69.9 -27.95 34.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.141 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.552 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 6.7 p90 -86.1 3.66 41.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 693' ' ' ARG . 9.4 t70 -94.96 139.8 22.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.605 0.717 . . . . 0.0 110.864 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.427 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.8 -34.02 15.3 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.675 2.25 . . . . 0.0 112.323 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.469 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 16.8 mtm-85 -67.49 -20.03 65.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.881 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -65.8 -16.96 64.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.969 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.1 mt -113.27 16.84 18.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.921 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.469 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 54.8 mt -96.03 -19.68 19.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.846 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 30.8 mt -114.83 148.19 38.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.884 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 -50.1 161.91 0.54 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.6 0.715 . . . . 0.0 110.93 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -33.71 15.93 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.652 2.235 . . . . 0.0 112.288 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -72.01 -45.31 61.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.892 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 71.6 mm-40 -57.47 -53.47 57.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.565 ' HG2' ' CE2' ' A' ' 666' ' ' PHE . 10.7 mtp180 -34.42 -47.95 0.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -71.45 -45.35 62.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.892 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . 0.41 ' N ' ' O ' ' A' ' 701' ' ' GLU . 46.0 mm-40 -57.88 -59.26 5.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.906 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 91.6 t -55.62 -48.37 77.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.126 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -56.34 -43.8 79.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.917 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -55.32 -53.24 58.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.863 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -58.08 -38.83 77.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.887 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -62.8 -42.78 99.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.917 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 89.2 t -67.36 -41.61 86.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.163 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -59.14 -39.06 81.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.864 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 712' ' ' THR . . . . . 0.404 ' HA ' ' CG ' ' A' ' 715' ' ' GLU . 21.2 p -74.09 -40.38 62.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.123 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -66.17 -26.37 67.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.868 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -91.79 -49.19 6.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.094 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . 0.404 ' CG ' ' HA ' ' A' ' 712' ' ' THR . 2.2 pp20? -54.27 -34.72 61.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.891 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . 0.453 ' CD ' ' O ' ' A' ' 716' ' ' GLU . 0.1 OUTLIER -52.13 -17.96 1.28 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.91 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' A' ' 718' ' ' ARG . 8.4 tt0 -110.54 150.29 29.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.88 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 717' ' ' GLU . 9.5 mmp_? -34.5 -51.89 0.48 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.817 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 30.6 mtt180 -49.82 99.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.897 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 59.7 p -174.62 119.81 0.23 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -106.13 159.28 15.19 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.522 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.78 118.15 5.51 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.674 2.25 . . . . 0.0 112.38 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 723' ' ' SER . . . . . 0.418 ' O ' ' C ' ' A' ' 724' ' ' SER . 65.7 p -83.08 83.3 7.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.9 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 724' ' ' SER . . . . . 0.418 ' C ' ' O ' ' A' ' 723' ' ' SER . 6.8 t 37.04 42.86 0.27 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.827 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.523 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.45 -0.26 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 4.2 m 62.14 51.16 3.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.881 0.372 . . . . 0.0 110.859 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 66.8 m -84.75 140.99 30.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.882 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 171.14 109.6 0.23 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.466 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 50.0 m -113.88 -46.38 3.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.899 0.381 . . . . 0.0 110.865 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 51.4 p -169.21 176.5 5.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.834 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -167.27 125.99 1.38 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.455 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -39.11 130.12 1.59 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.761 0.315 . . . . 0.0 111.126 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -129.34 151.15 50.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.861 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -112.4 -59.62 1.98 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -108.18 158.31 17.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.854 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -83.43 80.1 9.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.094 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 73.9 mt -120.18 109.5 26.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.14 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 85.0 t -110.33 82.06 2.55 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.559 0.695 . . . . 0.0 111.107 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.82 167.52 24.28 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.684 2.256 . . . . 0.0 112.36 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 14.5 tp -51.91 -54.84 24.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.899 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -53.71 -35.86 61.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -64.0 -70.94 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.125 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -50.8 -48.14 59.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.831 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.5 mtt -54.05 -42.73 69.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.873 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -58.85 -47.4 84.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.902 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -55.42 -52.12 64.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.493 ' CD1' ' HE1' ' A' ' 669' ' ' MET . 25.1 t80 -54.46 -57.44 11.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.849 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 16.9 ttmt -54.63 -35.98 64.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.968 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -60.1 -52.85 63.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.493 ' HE1' ' CD1' ' A' ' 666' ' ' PHE . 2.7 ptt? -65.14 -36.58 84.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.901 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.423 HD12 ' CD2' ' A' ' 666' ' ' PHE . 32.0 mt -54.23 -49.35 69.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.889 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 31.2 tp -74.01 -52.02 14.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . 0.435 ' O ' ' N ' ' A' ' 674' ' ' GLY . 19.0 mt-10 -55.09 -65.77 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . 0.411 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 16.1 mmp_? -39.49 -28.54 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.838 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . 0.435 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 93.99 42.85 3.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.511 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 53.0 t -71.43 94.6 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.874 0.368 . . . . 0.0 111.131 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 57.7 m -58.83 125.41 23.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.85 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -64.72 -32.2 73.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.088 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -83.81 34.72 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.919 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.3 t -125.9 -175.03 3.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.897 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 12.9 t -106.17 158.76 16.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.13 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.401 ' CZ2' HD11 ' A' ' 685' ' ' LEU . 50.1 t-105 -63.28 -38.07 89.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.887 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -54.28 -57.13 12.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.911 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . 0.413 ' HB3' ' NZ ' ' A' ' 687' ' ' LYS . 5.9 mtpm? -60.64 -59.62 5.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.905 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -52.55 -34.69 51.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.401 HD11 ' CZ2' ' A' ' 681' ' ' TRP . 8.3 tp -59.11 -62.1 2.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.913 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.584 ' CD2' ' N ' ' A' ' 687' ' ' LYS . 1.5 p-80 -50.58 -35.06 28.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.848 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.584 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 44.0 mttp -63.87 -40.03 95.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.911 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 12.0 pt -105.22 13.9 7.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.137 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 3.1 p -79.81 -24.32 12.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.161 179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 12.2 p90 -75.42 -44.35 44.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.852 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.471 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 7.3 t70 -53.13 139.42 45.08 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.619 0.723 . . . . 0.0 110.832 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.406 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.2 Cg_endo -69.77 -34.77 13.87 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.715 2.277 . . . . 0.0 112.345 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.461 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 36.6 mtm180 -58.41 -17.45 20.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.896 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -66.61 -15.55 63.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.892 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 27.8 mt -103.65 -12.31 17.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.926 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 64.7 mt -62.42 -52.76 62.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.454 ' CD1' ' HB2' ' A' ' 666' ' ' PHE . 30.6 mt -84.67 148.05 26.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -56.22 162.47 3.03 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.634 0.73 . . . . 0.0 110.91 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . 0.537 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.8 Cg_endo -69.7 -32.12 19.43 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.731 2.287 . . . . 0.0 112.352 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 44.1 mttt -72.29 -46.81 54.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.899 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -60.34 -51.76 68.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.92 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.537 HH21 ' N ' ' A' ' 699' ' ' PRO . 44.6 mtm180 -39.27 -45.38 1.39 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.9 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -70.91 -43.49 68.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.907 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -60.89 -59.54 5.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.94 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.8 t -54.65 -41.45 55.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.114 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -60.18 -48.33 82.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -54.02 -47.29 71.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.803 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -65.95 -41.26 91.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.892 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.511 ' CZ ' ' HG3' ' A' ' 713' ' ' ARG . 12.6 t80 -61.82 -47.9 83.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.892 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 92.9 t -59.46 -43.99 91.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.1 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -57.31 -49.2 76.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.915 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 13.8 p -64.63 -41.46 96.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.128 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.511 ' HG3' ' CZ ' ' A' ' 709' ' ' TYR . 3.4 mmp_? -64.63 -36.62 84.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.888 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -74.46 -51.01 16.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.113 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -56.44 -41.89 77.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.866 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -84.56 28.54 0.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.846 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -129.41 139.59 51.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.906 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -84.12 156.71 22.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.878 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 6.3 tpp85 -119.4 134.92 54.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.884 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 1.2 t -48.03 158.75 0.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.855 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -49.79 144.37 9.69 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.49 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 176.15 7.14 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.674 2.25 . . . . 0.0 112.338 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 87.2 p -173.73 171.65 3.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.886 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 23.1 t -84.51 92.77 8.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.868 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.481 -179.996 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 48.3 t -91.45 159.54 15.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.858 0.361 . . . . 0.0 110.859 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 42.1 t -119.62 -47.94 2.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.892 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 149.79 127.11 1.49 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.508 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 49.9 m -134.22 122.63 23.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.895 0.378 . . . . 0.0 110.826 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 35.2 p -90.51 -60.89 1.8 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.889 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 66.06 81.88 0.13 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.512 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -106.05 101.98 11.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.782 0.325 . . . . 0.0 111.092 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 46.8 ttm-85 -132.73 106.05 7.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.872 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -90.39 41.01 1.03 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -126.96 151.03 49.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.911 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -101.75 34.7 2.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.103 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 68.7 mt -102.49 103.32 14.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.166 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 92.9 t -103.0 124.59 38.0 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.627 0.727 . . . . 0.0 111.097 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 163.21 39.12 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.68 2.253 . . . . 0.0 112.347 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 10.4 tp -58.47 -48.62 80.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -55.36 -37.51 67.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -63.76 -66.1 0.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.124 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . 0.457 ' HG3' ' CD2' ' A' ' 697' ' ' LEU . 11.2 ptt180 -51.5 -48.22 62.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.915 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.0 mtt -56.08 -47.58 77.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.906 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -52.59 -45.62 66.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.912 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -58.28 -62.35 1.9 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.926 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -45.1 -55.61 5.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.892 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -54.74 -48.11 72.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.882 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -47.84 -41.58 24.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.405 ' O ' ' C ' ' A' ' 670' ' ' LEU . 5.5 mtm -67.53 -63.96 0.95 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.883 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.405 ' C ' ' O ' ' A' ' 669' ' ' MET . 44.6 mt -38.01 -34.85 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.916 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 15.9 tp -83.25 -56.03 4.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -54.71 -64.32 0.87 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.904 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . 0.403 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 2.5 mmp_? -44.38 -29.68 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.897 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 90.29 33.22 8.88 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.473 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.9 116.29 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 0.0 111.135 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 58.1 m -75.3 144.92 42.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.888 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -82.68 -28.98 30.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.076 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -77.33 -2.06 33.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.853 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.2 m -90.57 -177.84 5.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.862 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 65.8 p -104.46 160.88 14.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.183 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.546 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 29.7 t-105 -64.75 -27.08 68.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.882 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -61.47 -58.83 6.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.868 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 17.0 mttm -55.73 -58.98 5.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.91 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -56.19 -44.85 79.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.869 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.546 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 6.4 tp -46.55 -62.26 1.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.929 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 3.5 p-80 -58.63 -30.62 67.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.868 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 43.5 mttm -69.34 -20.99 63.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 30.0 pt -122.68 8.31 5.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.189 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 3.2 p -77.7 -29.0 15.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.156 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.462 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 12.0 p90 -70.56 -44.43 67.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.915 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.462 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.6 t70 -53.22 139.76 45.19 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.573 0.702 . . . . 0.0 110.911 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.3 Cg_endo -69.67 -34.29 15.19 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.713 2.275 . . . . 0.0 112.369 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.461 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 16.5 mtm-85 -56.63 -24.39 47.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.874 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.432 ' CZ ' ' HD2' ' A' ' 702' ' ' ARG . 22.0 t80 -65.92 -17.88 64.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.888 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 15.8 mt -107.19 23.13 14.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 78.5 mt -104.22 -29.5 10.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.89 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.457 ' CD2' ' HG3' ' A' ' 662' ' ' ARG . 26.7 mt -102.84 151.22 22.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.897 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 23.4 m-20 -50.74 161.85 0.62 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.635 0.731 . . . . 0.0 110.892 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . 0.415 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 54.1 Cg_endo -69.74 -37.1 9.69 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.725 2.283 . . . . 0.0 112.347 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -72.19 -39.28 68.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.916 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.451 ' O ' ' C ' ' A' ' 702' ' ' ARG . 35.7 mm-40 -59.88 -53.94 51.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.904 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.451 ' C ' ' O ' ' A' ' 701' ' ' GLU . 29.0 mtm105 -34.1 -48.03 0.3 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.914 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 16.5 tptt -72.35 -43.74 63.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.953 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' A' ' 701' ' ' GLU . 29.1 mt-30 -57.28 -56.92 15.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.908 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.72 -48.59 88.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.148 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -57.2 -36.73 71.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.863 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -64.87 -51.5 61.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.864 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 87.8 mm-40 -58.2 -36.34 72.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -67.18 -41.48 85.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.974 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 96.7 t -69.42 -39.3 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.151 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 17.1 tttm -62.99 -40.58 98.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 73.0 p -75.13 -38.59 61.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.13 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 5.8 mmm180 -60.23 -36.29 77.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' A' ' 717' ' ' GLU . . . -83.93 -58.88 2.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.111 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -47.9 -26.53 1.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.922 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -94.61 26.41 3.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.886 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 714' ' ' ALA . 3.4 tm-20 -54.83 91.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.916 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 19.2 ptt180 -84.92 161.93 19.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.885 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 13.5 ttm180 -43.12 152.46 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.874 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 23.3 m -47.78 128.48 13.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.812 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 165.4 76.09 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.455 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 157.94 58.7 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.703 2.268 . . . . 0.0 112.359 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 9.8 t -128.18 118.78 23.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.901 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 724' ' ' SER . . . . . 0.448 ' O ' ' C ' ' A' ' 725' ' ' GLY . 83.3 p -55.33 -44.57 75.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.851 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . 0.448 ' C ' ' O ' ' A' ' 724' ' ' SER . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.496 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.384 0 N-CA-C 112.506 -0.237 . . . . 0.0 112.506 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 1.1 t -127.93 102.73 6.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.892 0.377 . . . . 0.0 110.822 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 16.7 p -72.66 -15.6 61.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.853 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 62.92 108.62 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.472 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 3.4 m -112.2 86.03 2.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.865 0.364 . . . . 0.0 110.851 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 2.3 m -153.61 172.42 17.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 142.46 82.02 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.481 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -101.83 116.62 33.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.787 0.327 . . . . 0.0 111.071 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -105.33 124.52 49.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.882 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -79.41 -65.81 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.913 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 9.5 mmp_? -96.83 -179.14 4.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.882 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -95.75 53.29 1.41 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.089 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 27.5 mt -123.7 88.32 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.106 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . 0.425 HG21 ' CB ' ' A' ' 661' ' ' ALA . 4.3 p -74.96 130.39 81.08 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.574 0.702 . . . . 0.0 111.145 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 154.98 66.92 Favored 'Trans proline' 0 C--O 1.232 0.222 0 C-N-CA 122.663 2.242 . . . . 0.0 112.289 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . 0.415 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 15.2 tp -49.93 -49.74 48.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.87 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -54.35 -41.16 68.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.918 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . 0.425 ' CB ' HG21 ' A' ' 657' ' ' VAL . . . -62.31 -70.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.091 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . 0.415 ' NE ' ' HA ' ' A' ' 659' ' ' LEU . 7.6 ptt180 -48.46 -46.76 38.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.878 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.3 mtt -57.5 -46.53 83.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.846 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 3.7 mmmm -53.43 -45.83 69.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.887 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -58.16 -60.91 3.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.897 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.531 ' CD1' ' HE3' ' A' ' 669' ' ' MET . 18.0 t80 -48.72 -58.74 4.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.922 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 51.5 tttt -51.84 -37.45 52.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.919 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -58.71 -54.18 49.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.896 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.531 ' HE3' ' CD1' ' A' ' 666' ' ' PHE . 2.7 ptt? -65.42 -37.07 85.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.908 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 30.0 mt -52.0 -50.62 60.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 37.7 tp -74.74 -47.36 31.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -56.74 -66.08 0.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.906 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -42.64 -25.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.853 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 85.98 44.34 6.04 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.479 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . 0.418 HG11 ' CD ' ' A' ' 684' ' ' GLU . 25.8 t -68.37 109.62 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.784 0.326 . . . . 0.0 111.1 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 24.5 m -67.51 136.45 54.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.831 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -69.58 -55.74 9.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.125 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -54.27 -30.81 51.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.852 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.9 m -55.83 167.14 0.61 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.863 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 44.8 p -93.88 153.45 18.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.154 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 33.9 t-105 -57.47 -26.1 60.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.933 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.25 -60.24 3.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.881 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -54.03 -59.07 5.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.87 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . 0.418 ' CD ' HG11 ' A' ' 675' ' ' VAL . 59.6 mm-40 -54.39 -43.98 71.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 7.0 tp -48.23 -57.63 5.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.51 ' CD2' ' C ' ' A' ' 686' ' ' HIS . 1.5 p-80 -59.29 -33.74 71.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.839 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.475 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 24.5 mttp -65.29 -26.08 67.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 16.4 pt -117.29 7.87 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.153 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 3.2 p -76.88 -35.91 24.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.11 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.451 ' CE1' ' O ' ' A' ' 687' ' ' LYS . 47.9 p90 -83.41 13.84 4.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 693' ' ' ARG . 2.9 t70 -102.46 143.61 26.95 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.614 0.721 . . . . 0.0 110.843 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.416 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.74 -46.81 1.1 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.688 2.259 . . . . 0.0 112.332 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.497 ' N ' ' OD1' ' A' ' 691' ' ' ASP . 54.8 mtm180 -53.96 -26.06 23.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.607 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 0.7 OUTLIER -66.48 -27.92 68.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.938 -179.858 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.9 mt -89.0 2.85 53.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.964 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.469 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 94.8 mt -86.98 -42.22 13.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.912 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.416 ' O ' ' NE ' ' A' ' 702' ' ' ARG . 29.7 mt -91.17 144.46 25.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.891 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -51.41 161.85 0.75 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.58 0.705 . . . . 0.0 110.923 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -35.1 13.31 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.682 2.255 . . . . 0.0 112.34 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -72.09 -45.95 58.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -59.38 -45.55 91.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.839 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.607 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 42.0 mtt180 -43.45 -45.14 6.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.822 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.11 -44.68 62.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.875 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -57.6 -60.0 4.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.93 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 72.2 t -55.21 -47.12 77.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.159 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -56.59 -41.25 76.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.897 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -59.12 -49.54 77.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.848 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -62.04 -42.63 99.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.93 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.567 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 7.0 t80 -58.75 -37.67 76.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.958 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 96.8 t -69.88 -45.89 75.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.162 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 26.9 tttm -51.95 -51.94 53.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.903 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 3.9 p -68.81 -31.1 69.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.175 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.567 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 3.2 mmm180 -65.96 -33.76 76.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.924 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -82.32 -46.84 13.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.138 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 717' ' ' GLU . 4.5 pt-20 -54.88 -43.18 72.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.941 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . 0.417 ' N ' ' CG ' ' A' ' 715' ' ' GLU . 16.4 tm-20 -39.67 -26.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.923 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . 0.466 ' N ' ' O ' ' A' ' 715' ' ' GLU . 0.0 OUTLIER -67.57 106.14 2.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.889 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . 0.441 ' C ' ' O ' ' A' ' 717' ' ' GLU . 8.7 ttt180 -34.35 143.48 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -120.79 142.64 49.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 28.7 t -46.04 101.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 167.67 151.94 7.25 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.499 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -11.59 31.19 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.691 2.261 . . . . 0.0 112.33 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 57.9 m -38.67 130.34 1.4 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.831 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 22.5 t -144.82 158.27 43.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.845 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.475 179.999 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.514 -0.234 . . . . 0.0 112.514 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 46.0 m -101.29 42.06 1.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.898 0.38 . . . . 0.0 110.858 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 4.4 t -101.64 -56.52 2.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.832 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 113.59 95.06 2.12 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.5 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 4.5 m -96.18 98.79 10.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.87 0.367 . . . . 0.0 110.861 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 40.5 t -164.29 139.45 5.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.841 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 155.74 102.36 0.2 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.49 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -93.41 99.75 12.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.785 0.326 . . . . 0.0 111.098 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 8.3 ptt-85 -75.07 136.03 41.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.869 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -121.78 -47.53 2.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.874 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 23.9 mmt180 -97.45 161.26 13.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.858 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -87.34 80.87 8.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.074 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 65.9 mt -138.11 115.56 12.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.094 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . 0.403 ' HA ' ' HD2' ' A' ' 658' ' ' PRO . 88.1 t -101.49 98.1 8.74 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.604 0.716 . . . . 0.0 111.146 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 657' ' ' VAL . 54.3 Cg_endo -69.78 152.24 69.17 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.664 2.243 . . . . 0.0 112.352 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . 0.42 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 13.2 tp -49.25 -44.51 43.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -58.95 -42.26 89.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -61.0 -65.06 0.75 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.065 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . 0.42 ' NE ' ' HA ' ' A' ' 659' ' ' LEU . 10.3 ptt180 -53.18 -54.33 37.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.904 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.7 mtt -51.47 -46.06 62.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.846 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.4 -43.4 71.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -59.55 -58.76 7.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.894 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.44 ' HB2' ' CD1' ' A' ' 697' ' ' LEU . 26.9 t80 -50.64 -51.31 50.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.89 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 27.4 tttt -60.89 -35.35 76.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.927 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -61.8 -56.61 17.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -59.87 -36.24 76.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.887 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 34.6 mt -56.95 -48.59 77.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.906 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.77 -45.23 62.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' A' ' 674' ' ' GLY . 23.2 mt-10 -61.67 -65.81 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -41.5 -24.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 86.71 46.86 5.02 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.452 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . 0.413 HG12 ' CD ' ' A' ' 684' ' ' GLU . 24.4 t -72.22 106.4 2.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.829 0.347 . . . . 0.0 111.13 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 9.3 t -65.59 140.02 58.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.866 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -78.75 -44.07 24.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.072 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -63.78 -20.89 66.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.4 m -69.04 -175.52 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.868 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 12.5 t -106.61 167.24 9.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.136 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.498 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 31.4 t-105 -69.13 -26.8 65.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.866 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -61.2 -63.01 1.43 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.875 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -52.67 -59.03 4.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . 0.413 ' CD ' HG12 ' A' ' 675' ' ' VAL . 49.1 mm-40 -55.51 -44.54 76.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.498 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.3 tp -47.79 -55.99 8.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.914 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.487 ' C ' ' CD2' ' A' ' 686' ' ' HIS . 1.8 p-80 -61.9 -31.82 72.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.469 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 82.5 mttt -66.66 -24.91 66.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.918 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 20.9 pt -120.68 9.01 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.103 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 4.0 p -75.22 -26.69 18.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.175 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -84.65 -39.05 19.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.877 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.422 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 8.6 t70 -43.59 139.78 2.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.655 0.741 . . . . 0.0 110.867 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.82 -36.28 10.94 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.638 2.225 . . . . 0.0 112.357 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.468 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 57.0 mtm180 -65.16 -20.07 66.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.856 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.573 ' CD1' ' C ' ' A' ' 694' ' ' TYR . 0.6 OUTLIER -66.03 -21.29 66.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.926 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 52.1 mt -93.89 -13.76 26.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.905 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.468 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 63.7 mt -67.47 -52.05 43.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.44 ' CD1' ' HB2' ' A' ' 666' ' ' PHE . 33.3 mt -79.72 147.23 32.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.91 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -51.51 162.54 0.69 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.627 0.727 . . . . 0.0 110.89 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . 0.412 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 53.5 Cg_endo -69.75 -36.61 10.51 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.683 2.255 . . . . 0.0 112.335 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -72.19 -41.68 66.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 15.7 mt-10 -58.68 -51.22 70.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.567 ' HD2' ' CE2' ' A' ' 694' ' ' TYR . 24.7 mtm105 -34.23 -50.88 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.849 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -70.56 -46.2 63.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -55.47 -61.16 2.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.926 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 65.9 t -54.06 -45.19 65.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.086 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.68 -52.42 63.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.866 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -51.13 -47.19 62.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -63.4 -39.82 95.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.555 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 20.3 t80 -63.69 -49.63 72.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.921 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 82.4 t -55.93 -42.49 71.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.128 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -60.3 -46.17 90.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.899 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 15.8 p -65.8 -37.33 86.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.119 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.555 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.3 mmm180 -67.04 -28.73 68.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -83.18 -46.91 12.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.104 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -57.94 -38.45 75.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.91 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -90.1 29.77 1.18 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -47.89 112.78 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.897 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -42.45 -51.54 4.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -74.34 86.33 1.98 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.882 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 60.6 p -150.03 154.81 38.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.854 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -67.27 -77.45 0.31 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.481 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 120.85 7.56 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.662 2.242 . . . . 0.0 112.299 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 3.1 m -91.03 144.01 26.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 47.1 t -157.73 136.54 11.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.81 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.468 -179.995 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 16.0 t -102.05 102.86 13.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.93 0.395 . . . . 0.0 110.82 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 18.2 m -68.47 113.89 6.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.843 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 69.09 125.79 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.498 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 62.8 p -91.48 -43.82 9.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.864 0.364 . . . . 0.0 110.836 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 83.6 p -159.08 144.41 16.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.839 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -117.85 96.99 0.71 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.423 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -80.16 167.74 19.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.746 0.307 . . . . 0.0 111.132 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 9.7 mmp_? -111.5 43.36 1.52 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.891 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -131.77 168.84 17.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -119.31 -57.57 1.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.856 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -98.5 41.6 1.13 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.1 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 48.6 mm -126.41 81.94 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.143 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 2.2 m -49.63 149.95 3.94 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.604 0.716 . . . . 0.0 111.128 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 162.35 42.4 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.674 2.249 . . . . 0.0 112.34 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 31.4 tp -54.69 -51.11 66.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.933 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 12.0 mm-40 -55.64 -30.5 61.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.92 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -71.84 -70.99 0.3 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.126 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . 0.462 ' CZ ' HD23 ' A' ' 697' ' ' LEU . 0.1 OUTLIER -48.35 -52.69 20.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.897 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 6.0 mtt -54.84 -48.48 72.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . 0.467 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 1.7 mmmm -53.16 -37.45 61.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.916 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -64.01 -56.42 15.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.906 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.535 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 29.4 t80 -52.31 -47.61 65.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 41.3 tttt -67.26 -34.26 77.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.92 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -62.99 -44.76 95.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.877 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.441 ' HE2' ' CE1' ' A' ' 666' ' ' PHE . 2.8 ptt? -70.35 -32.36 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 40.8 mt -60.85 -49.82 75.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.892 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.5 tp -70.89 -55.91 7.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.942 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . 0.405 ' C ' ' N ' ' A' ' 674' ' ' GLY . 15.9 mt-10 -49.31 -63.58 1.06 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . 0.431 ' CG ' ' O ' ' A' ' 669' ' ' MET . 4.6 mmp_? -45.67 -21.31 0.11 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.843 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . 0.405 ' N ' ' C ' ' A' ' 672' ' ' GLU . . . 85.7 46.02 5.57 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.486 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 70.9 t -78.32 103.56 5.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 111.142 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 16.4 m -67.7 158.51 32.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.871 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -88.57 -36.81 16.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.072 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -66.55 -10.08 41.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.919 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.1 m -82.7 175.49 10.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.822 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 59.4 p -102.44 178.33 4.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.172 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.462 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 50.6 t-105 -76.08 -25.22 55.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.933 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -67.15 -56.76 8.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.883 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . 0.498 ' O ' ' CD2' ' A' ' 686' ' ' HIS . 59.6 mttm -53.94 -59.03 5.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.875 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -57.77 -45.8 85.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.462 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 7.9 tp -45.27 -53.38 8.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.921 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.498 ' CD2' ' O ' ' A' ' 683' ' ' LYS . 1.7 p80 -68.41 -28.65 67.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.897 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.562 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 37.9 mttm -68.96 -21.12 64.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 26.1 pt -121.96 -0.38 7.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.115 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 8.7 p -62.82 -25.32 38.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.13 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.562 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 18.6 p90 -93.59 11.66 28.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.835 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.428 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.5 t70 -99.3 139.85 21.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.596 0.712 . . . . 0.0 110.877 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.78 -31.78 19.78 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.688 2.259 . . . . 0.0 112.302 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 22.4 mtm-85 -67.21 -21.49 65.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.841 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.473 ' O ' ' CD1' ' A' ' 694' ' ' TYR . 10.6 t80 -68.55 -5.53 20.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.1 mt -120.91 14.8 11.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.944 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 55.5 mt -95.51 -26.18 15.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.939 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.462 HD23 ' CZ ' ' A' ' 662' ' ' ARG . 29.8 mt -112.12 155.56 23.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -54.47 158.52 4.02 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.603 0.716 . . . . 0.0 110.884 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . 0.408 ' HA ' ' NE ' ' A' ' 702' ' ' ARG . 53.2 Cg_endo -69.82 -33.73 15.77 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.626 2.217 . . . . 0.0 112.345 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -72.69 -46.01 55.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.945 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' A' ' 704' ' ' GLN . 0.4 OUTLIER -62.35 -54.52 39.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.877 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.535 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 57.0 mtm180 -34.21 -48.29 0.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.902 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.57 -41.34 69.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.901 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 701' ' ' GLU . 21.5 mm-40 -60.39 -56.63 19.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 33.2 t -57.31 -43.25 81.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.116 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -62.17 -37.93 87.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.891 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -60.86 -49.86 75.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.863 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -61.44 -35.34 77.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.525 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 0.8 OUTLIER -65.65 -35.98 82.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.954 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 93.5 t -70.95 -51.3 36.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.135 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 12.9 ttmt -56.8 -35.81 69.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.918 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 15.6 p -75.1 -39.78 60.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.184 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.525 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 2.4 mmp_? -64.32 -35.66 81.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.85 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -82.88 -55.19 4.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.112 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -52.57 -28.82 22.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.875 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -93.72 25.45 3.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.919 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -65.83 83.31 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.878 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -86.2 149.2 25.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.876 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -110.35 -62.36 1.53 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.916 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 4.2 m -94.09 168.91 10.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.891 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -65.04 146.24 50.05 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.497 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 134.51 28.13 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.706 2.271 . . . . 0.0 112.304 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 90.8 p -111.83 -12.99 13.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.866 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 45.5 m -123.88 151.19 43.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.852 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.499 179.995 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 5.7 t -88.06 133.88 33.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.893 0.378 . . . . 0.0 110.834 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 15.0 t -160.99 153.25 20.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.858 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 149.73 -52.85 0.52 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.513 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 53.7 p 46.31 41.23 8.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.87 0.367 . . . . 0.0 110.828 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 4.4 t 69.74 43.25 0.98 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.897 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -100.21 79.87 0.47 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.487 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -134.81 129.74 35.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.796 0.331 . . . . 0.0 111.097 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 39.6 mtp180 -60.8 -66.18 0.57 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . 0.503 ' OE2' ' CZ ' ' A' ' 654' ' ' ARG . 5.1 tp10 -100.51 174.53 6.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.931 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . 0.503 ' CZ ' ' OE2' ' A' ' 653' ' ' GLU . 0.0 OUTLIER -93.66 -14.53 26.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.896 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -130.67 22.05 5.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.101 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 63.1 mt -140.17 123.58 17.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.106 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 25.7 m -65.81 149.81 97.06 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.629 0.728 . . . . 0.0 111.164 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 158.45 56.92 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.724 2.283 . . . . 0.0 112.338 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . 0.422 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 18.6 tp -48.05 -49.05 32.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -55.53 -41.13 72.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -61.47 -67.64 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . 0.45 ' HG3' ' CD2' ' A' ' 697' ' ' LEU . 7.9 ptt180 -51.14 -46.4 61.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.869 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 6.7 mtt -58.83 -49.47 77.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.895 179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 16.3 mtmt -49.62 -46.24 49.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . 0.471 ' OE1' ' CD1' ' A' ' 696' ' ' LEU . 86.4 mt-30 -59.33 -64.1 1.06 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.885 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.549 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 27.6 t80 -41.52 -56.95 2.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.88 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 35.1 tttp -54.94 -47.41 74.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -50.59 -33.17 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.854 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.423 ' O ' ' C ' ' A' ' 670' ' ' LEU . 5.4 mtm -74.58 -65.79 0.82 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' A' ' 669' ' ' MET . 83.6 mt -35.3 -40.91 0.15 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.89 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.9 tp -76.67 -58.15 3.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.934 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 674' ' ' GLY . 8.3 mm-40 -57.78 -64.3 0.95 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . 0.434 ' C ' ' O ' ' A' ' 672' ' ' GLU . 4.2 mmp_? -35.02 -34.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.873 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 98.03 42.27 3.09 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.419 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 94.9 t -75.56 136.94 23.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.844 0.354 . . . . 0.0 111.156 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 15.9 m -103.7 121.89 43.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.841 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -45.98 -57.88 4.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.121 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -46.46 -30.24 2.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.902 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.87 160.72 11.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.854 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 14.4 t -82.33 -177.74 6.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.146 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.546 ' CZ2' HD12 ' A' ' 685' ' ' LEU . 19.3 t-105 -84.3 -34.52 23.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.938 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -64.32 -59.86 3.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . 0.443 ' O ' ' ND1' ' A' ' 686' ' ' HIS . 12.4 mtpt -46.25 -58.94 3.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.915 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -62.64 -47.58 83.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.852 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.546 HD12 ' CZ2' ' A' ' 681' ' ' TRP . 7.3 tp -43.16 -48.54 6.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.92 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.524 ' CD2' ' C ' ' A' ' 686' ' ' HIS . 0.9 OUTLIER -70.42 -38.43 74.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.85 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.517 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 44.3 mttp -60.56 -19.56 57.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.835 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 19.5 pt -115.39 -16.78 8.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.147 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . 0.444 HG13 ' N ' ' A' ' 690' ' ' PHE . 3.2 p -55.26 -32.41 28.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.143 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.444 ' N ' HG13 ' A' ' 689' ' ' VAL . 2.9 p90 -62.74 -36.41 82.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.861 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.423 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 8.5 t70 -64.0 139.74 97.73 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.609 0.719 . . . . 0.0 110.848 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.8 -36.92 9.82 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.708 2.272 . . . . 0.0 112.315 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.46 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 22.3 mtm-85 -56.39 -19.72 16.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.852 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.614 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 27.5 t80 -66.76 -18.5 65.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.894 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 20.1 mt -96.3 -3.85 43.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.471 ' CD1' ' OE1' ' A' ' 665' ' ' GLN . 83.0 mt -77.09 -43.72 33.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.911 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.45 ' CD2' ' HG3' ' A' ' 662' ' ' ARG . 31.9 mt -89.88 152.24 21.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.904 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 24.2 m-20 -61.84 162.1 18.56 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.663 0.744 . . . . 0.0 110.849 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . 0.403 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.4 Cg_endo -69.7 -34.06 15.57 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.694 2.262 . . . . 0.0 112.364 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 29.3 mttm -72.13 -47.07 53.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 24.4 mt-10 -60.75 -56.53 20.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.903 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.614 ' NH1' ' CE2' ' A' ' 694' ' ' TYR . 46.0 mtm180 -34.59 -45.41 0.24 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.849 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.34 -45.76 62.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . 0.435 ' N ' ' O ' ' A' ' 701' ' ' GLU . 11.2 mm100 -57.12 -50.35 73.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.914 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.64 -39.24 83.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.11 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -65.22 -36.84 85.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.859 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -64.68 -52.39 57.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.88 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . 0.45 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 5.5 pt20 -60.67 -36.65 79.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.913 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.47 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 11.7 t80 -66.76 -39.5 87.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.924 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 99.6 t -64.55 -45.63 95.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.196 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.38 -52.22 66.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.9 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 18.4 p -60.16 -37.79 81.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.157 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.47 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 3.4 mmp_? -65.11 -38.28 90.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.902 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -74.12 -54.95 6.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.142 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -51.65 -39.32 57.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.868 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -87.55 30.35 0.81 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.16 99.49 9.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -104.39 -41.54 5.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.852 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -93.36 109.79 21.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.835 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 40.5 m -100.02 166.2 11.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -69.59 146.98 44.6 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.441 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 -37.62 8.87 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.679 2.253 . . . . 0.0 112.319 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 6.1 t -137.99 156.56 47.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.847 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 50.3 m -80.38 146.18 31.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.857 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.379 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.493 -179.981 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 6.6 t -104.0 166.33 10.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.881 0.372 . . . . 0.0 110.842 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 71.4 m -132.4 -49.39 0.92 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.896 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 140.37 168.04 11.23 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.473 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 81.1 p -150.07 164.94 34.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.886 0.374 . . . . 0.0 110.868 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 60.7 p -108.82 -42.96 4.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.837 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 76.75 123.16 0.2 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.469 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -112.34 87.21 2.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.75 0.309 . . . . 0.0 111.112 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 5.9 ptp85 -134.44 174.79 10.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.883 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -95.66 -58.28 2.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.894 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -117.11 134.62 54.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -66.64 96.07 0.37 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.077 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 4.4 mm -131.19 96.05 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.104 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 15.8 m -56.27 150.43 32.23 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.635 0.731 . . . . 0.0 111.135 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 160.66 48.89 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.629 2.219 . . . . 0.0 112.366 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 25.3 tp -51.14 -48.57 61.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.938 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . 0.485 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 14.1 pt-20 -56.03 -36.19 67.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.87 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.41 -71.07 0.22 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.148 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -46.53 -56.98 5.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 -179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.9 mtt -50.69 -49.8 56.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.902 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . 0.485 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 2.5 mmmm -51.74 -41.09 61.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.91 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -60.8 -56.46 20.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.883 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.552 ' CD1' ' HE3' ' A' ' 669' ' ' MET . 24.8 t80 -51.73 -55.55 19.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.83 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -54.89 -35.86 64.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.928 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -60.14 -47.58 85.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.856 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.552 ' HE3' ' CD1' ' A' ' 666' ' ' PHE . 2.9 ptt? -72.75 -36.4 67.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.894 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 33.1 mt -52.42 -51.19 60.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.965 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 23.3 tp -76.96 -53.62 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.939 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -49.64 -61.44 2.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.874 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 15.6 mmp_? -49.42 -19.57 0.56 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 82.09 44.34 7.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.45 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 71.7 t -70.13 103.54 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.839 0.352 . . . . 0.0 111.136 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 19.4 t -63.0 145.54 55.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.824 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -81.58 -36.85 28.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.1 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -72.75 -9.11 58.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.865 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.1 m -80.94 168.13 19.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.885 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 15.2 t -95.81 173.62 7.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.182 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.467 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 57.0 t-105 -70.64 -30.82 67.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.876 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -59.79 -59.16 5.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . 0.562 ' HA ' ' CD2' ' A' ' 686' ' ' HIS . 38.5 mttm -56.78 -59.01 5.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 56.5 mm-40 -55.51 -39.27 70.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.872 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.467 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 8.0 tp -53.37 -59.6 4.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.868 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.562 ' CD2' ' HA ' ' A' ' 683' ' ' LYS . 2.0 p80 -60.02 -27.6 67.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.879 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.532 ' HG3' ' CE1' ' A' ' 686' ' ' HIS . 47.6 mttm -69.25 -34.18 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.877 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 7.5 pt -111.26 9.66 8.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.125 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 9.8 p -70.25 -32.71 51.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.117 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 5.2 p90 -77.1 -38.49 52.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.864 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.447 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 9.1 t70 -50.94 139.76 21.96 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.559 0.695 . . . . 0.0 110.887 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.2 Cg_endo -69.76 -37.82 8.64 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.693 2.262 . . . . 0.0 112.329 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.447 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 14.4 mtm-85 -58.87 -20.98 56.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.88 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.438 ' OH ' ' CD1' ' A' ' 685' ' ' LEU . 61.8 t80 -69.2 -7.76 39.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.912 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 33.2 mt -119.07 20.48 12.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.447 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 96.7 mt -104.57 -34.98 8.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.934 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 29.1 mt -101.55 144.34 30.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.92 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -48.7 161.88 0.39 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.659 0.742 . . . . 0.0 110.842 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . 0.412 ' HA ' ' NE ' ' A' ' 702' ' ' ARG . 54.3 Cg_endo -69.7 -33.88 15.89 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.693 2.262 . . . . 0.0 112.358 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 3.9 mptt -72.15 -44.96 62.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.836 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.508 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -61.28 -50.74 71.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.895 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.412 ' NE ' ' HA ' ' A' ' 699' ' ' PRO . 53.8 mtm180 -39.97 -45.28 1.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . 0.406 ' HD2' ' C ' ' A' ' 703' ' ' LYS . 2.0 tmmm? -71.68 -43.89 65.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.857 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -58.62 -58.17 9.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.0 t -57.56 -40.66 76.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.107 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -66.78 -30.66 70.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.922 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . 0.428 ' C ' ' OD1' ' A' ' 707' ' ' ASP . 0.8 OUTLIER -66.44 -55.28 16.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.864 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -57.9 -41.72 83.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.936 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.539 ' C ' ' CD1' ' A' ' 709' ' ' TYR . 0.8 OUTLIER -60.2 -41.01 92.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.953 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 92.8 t -63.56 -50.42 78.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.085 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -51.14 -51.62 51.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.907 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 2.3 p -60.18 -40.47 90.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.122 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.527 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 2.6 mmp_? -66.16 -26.96 67.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.842 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -80.15 -53.49 6.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.094 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -54.44 -39.67 67.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 717' ' ' GLU . 1.7 tp10 -83.99 20.63 1.49 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.877 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . 0.447 ' C ' ' O ' ' A' ' 716' ' ' GLU . 9.9 pt-20 -34.5 124.79 0.52 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.864 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.88 147.37 31.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 26.4 mtp180 -103.41 -66.18 0.96 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.855 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 44.0 t -124.71 163.1 22.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.879 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 168.23 159.79 14.61 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.489 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 141.23 44.91 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.718 2.278 . . . . 0.0 112.383 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 7.4 t -46.91 -57.02 5.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.884 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 27.0 m -109.28 131.52 54.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.882 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.491 -179.929 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 112.501 -0.239 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 99.4 p -156.23 165.4 36.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.927 0.394 . . . . 0.0 110.869 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 7.7 t -139.28 168.57 19.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.864 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . -178.71 80.67 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.483 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 2.9 t -132.06 87.37 2.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.863 0.363 . . . . 0.0 110.886 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 29.0 p -64.54 175.88 1.27 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.867 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 64.07 130.99 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.514 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -139.26 170.69 15.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.77 0.319 . . . . 0.0 111.116 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -100.92 145.83 28.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.913 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -52.7 -17.07 1.14 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.874 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -72.45 140.59 48.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.859 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -112.62 26.66 10.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.126 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 4.9 mp -103.01 93.7 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.144 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 10.5 m -53.99 145.71 32.2 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.578 0.704 . . . . 0.0 111.145 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 163.67 37.38 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.703 2.269 . . . . 0.0 112.333 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 23.7 tp -56.19 -48.71 75.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . 0.462 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 29.3 mt-10 -56.05 -32.64 64.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.848 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -69.97 -69.98 0.32 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.135 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -45.56 -48.09 14.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.855 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.5 mtt -56.39 -54.02 50.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.897 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . 0.462 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 3.3 mmpt? -48.37 -46.49 36.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -55.62 -63.37 1.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.44 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 22.8 t80 -45.38 -52.43 9.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.922 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -58.35 -44.22 88.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.861 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -51.47 -39.75 58.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.829 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 16.3 mtm -68.73 -58.6 3.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 52.6 mt -43.11 -38.37 2.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.911 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 15.4 tp -80.41 -58.88 2.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -52.85 -64.36 0.84 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.904 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -46.3 -25.76 0.69 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.821 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 85.78 31.07 22.04 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.468 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 24.4 t -53.84 108.74 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.857 0.36 . . . . 0.0 111.142 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 8.3 t -64.55 149.71 48.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.87 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -82.56 -39.82 21.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.118 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -66.53 -24.69 66.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.858 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.8 m -63.66 171.0 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.884 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 10.8 t -100.25 166.07 11.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 52.6 t-105 -63.53 -33.32 75.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.897 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -58.79 -56.11 26.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.88 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 26.6 mtmt -57.7 -59.08 5.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.881 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 56.1 mm-40 -55.99 -37.67 69.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.894 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 18.0 tp -53.75 -58.79 5.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.446 ' CD2' ' C ' ' A' ' 686' ' ' HIS . 2.5 p-80 -59.4 -32.03 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.822 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.549 ' O ' ' CE2' ' A' ' 690' ' ' PHE . 40.9 mttm -66.17 -29.03 69.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.868 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 20.1 pt -114.75 8.16 7.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.141 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 4.0 p -75.37 -34.53 30.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.127 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.549 ' CE2' ' O ' ' A' ' 687' ' ' LYS . 51.3 p90 -81.85 12.67 3.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.896 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.425 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 11.2 t70 -101.23 139.9 20.83 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.581 0.705 . . . . 0.0 110.849 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.72 -40.07 5.82 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.676 2.251 . . . . 0.0 112.347 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.424 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 16.1 mtm-85 -61.43 -30.96 70.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.836 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.442 ' CE1' ' HD3' ' A' ' 702' ' ' ARG . 41.2 t80 -59.91 -12.93 8.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.911 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.402 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 28.4 mt -108.58 19.76 19.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.911 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.424 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 97.6 mt -101.73 -48.59 4.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.876 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 29.0 mt -82.71 146.84 28.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.902 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -49.95 161.65 0.54 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.642 0.734 . . . . 0.0 110.92 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -34.31 14.96 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.723 2.282 . . . . 0.0 112.356 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -72.09 -45.23 61.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.897 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 702' ' ' ARG . 67.7 mm-40 -58.6 -50.77 72.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.9 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.442 ' HD3' ' CE1' ' A' ' 694' ' ' TYR . 68.7 mtt180 -35.82 -49.24 0.6 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.892 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 10.8 tptp -71.76 -44.83 63.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.854 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -57.46 -62.25 1.91 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.929 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 66.7 t -53.77 -48.43 61.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.17 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . 0.507 ' CE1' ' CG2' ' A' ' 710' ' ' VAL . 23.8 t80 -61.07 -37.46 82.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -57.27 -50.86 71.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.919 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -61.38 -40.5 94.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.557 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 4.2 t80 -63.52 -40.93 98.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.908 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . 0.507 ' CG2' ' CE1' ' A' ' 706' ' ' PHE . 85.4 t -67.03 -53.61 32.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.153 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 13.6 mtpp -48.69 -53.55 18.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.852 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 1.1 p -61.27 -41.44 96.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.119 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.557 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 12.7 mmm180 -64.23 -25.79 68.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.869 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -78.95 -44.41 22.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.09 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -67.5 -33.4 75.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . 0.432 ' O ' ' C ' ' A' ' 717' ' ' GLU . 3.7 tt0 -86.08 19.61 2.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.914 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . 0.432 ' C ' ' O ' ' A' ' 716' ' ' GLU . 9.8 pt-20 -36.21 133.62 0.47 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.86 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 22.7 ptt180 -109.28 124.4 50.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.873 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -42.88 112.44 0.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.899 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 1.7 t -72.66 107.84 5.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.851 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -82.84 -68.43 1.43 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.496 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . 0.446 ' O ' ' C ' ' A' ' 723' ' ' SER . 53.4 Cg_endo -69.8 2.67 3.34 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.664 2.243 . . . . 0.0 112.329 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 723' ' ' SER . . . . . 0.446 ' C ' ' O ' ' A' ' 722' ' ' PRO . 3.9 p -34.66 124.18 0.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.852 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 23.4 p -129.33 178.93 6.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.881 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.38 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.498 179.999 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 8.1 t 56.29 45.72 22.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.885 0.374 . . . . 0.0 110.851 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 5.7 m -130.73 156.79 44.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.854 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 166.19 116.43 0.36 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.498 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 52.1 p -171.84 126.45 0.59 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.88 0.372 . . . . 0.0 110.861 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 80.3 p -164.06 166.79 21.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.871 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 114.01 135.06 6.0 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.501 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -134.57 89.43 2.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.791 0.329 . . . . 0.0 111.068 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -127.21 139.39 52.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -125.66 96.06 4.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.877 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 21.7 tpp180 -115.87 145.69 42.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.873 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -84.18 34.8 0.52 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.068 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 32.6 mt -121.41 113.84 40.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.136 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 57.6 t -113.77 122.2 35.47 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.625 0.726 . . . . 0.0 111.138 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 146.56 60.49 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.635 2.223 . . . . 0.0 112.359 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 41.2 tp -49.26 -49.21 44.48 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.897 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -51.83 -39.69 59.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.878 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -66.59 -70.29 0.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.116 179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -44.05 -43.34 6.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.875 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.6 mtt -65.29 -40.32 93.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.86 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 17.3 mmmt -59.55 -41.41 90.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -65.16 -63.6 1.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.936 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.538 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 25.8 t80 -39.94 -57.2 1.66 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.861 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -54.64 -48.35 72.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.924 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -49.98 -35.39 24.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.848 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.427 ' O ' ' N ' ' A' ' 672' ' ' GLU . 4.7 mtm -71.84 -65.32 0.78 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.413 HD11 ' CE2' ' A' ' 666' ' ' PHE . 49.7 mt -36.83 -38.94 0.19 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.912 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 12.6 tp -75.51 -44.68 42.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . 0.427 ' N ' ' O ' ' A' ' 669' ' ' MET . 11.5 mm-40 -72.87 -64.55 0.94 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.892 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . 0.424 ' HA ' ' NE ' ' A' ' 673' ' ' ARG . 12.5 mmp_? -39.16 -35.68 0.25 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.847 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 98.66 28.67 7.78 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.46 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 38.0 t -59.43 91.78 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.847 0.356 . . . . 0.0 111.135 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 73.7 m -49.11 151.16 1.4 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.821 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -84.69 -48.11 9.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.127 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -56.36 -31.26 63.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.865 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -60.28 -178.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.889 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 10.9 t -104.45 -177.3 3.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.146 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.492 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 45.9 t-105 -83.05 -29.5 28.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.891 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -60.88 -60.79 3.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.881 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -54.15 -58.99 5.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.948 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 23.9 mm-40 -56.44 -42.51 78.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.895 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.492 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 7.7 tp -48.49 -54.92 12.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.985 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.493 ' C ' ' CD2' ' A' ' 686' ' ' HIS . 1.8 p-80 -63.67 -32.69 74.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 40.2 mttm -66.41 -23.22 66.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 22.4 pt -120.08 5.76 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.147 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 4.3 p -73.0 -25.24 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.117 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.577 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 13.1 p90 -76.25 -52.37 10.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.863 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.577 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.0 t70 -37.14 139.84 0.48 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.577 0.703 . . . . 0.0 110.862 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.5 Cg_endo -69.8 -36.49 10.61 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.631 2.22 . . . . 0.0 112.326 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.461 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 69.3 mtm180 -63.86 -19.44 65.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.53 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 27.7 t80 -66.07 -15.14 62.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.947 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 14.1 mt -101.47 3.71 40.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.897 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 80.3 mt -83.71 -49.58 8.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.885 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.447 ' CD1' ' HB2' ' A' ' 666' ' ' PHE . 30.7 mt -83.81 143.91 29.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -52.11 162.33 0.85 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.651 0.739 . . . . 0.0 110.873 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 -35.42 12.59 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.674 2.249 . . . . 0.0 112.349 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 35.5 mttm -72.16 -46.3 56.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.877 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -59.7 -51.2 70.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.538 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 47.3 mtm180 -40.09 -46.92 2.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.908 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -68.15 -45.89 72.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.884 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -58.04 -58.47 8.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 97.6 t -55.06 -37.47 42.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.121 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -69.0 -32.13 71.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.844 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -68.58 -47.21 67.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.829 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -68.17 -36.89 80.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.945 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.468 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 3.7 t80 -66.26 -41.02 90.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.931 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 57.7 t -65.55 -45.51 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.138 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 6.8 ttmm -57.97 -51.24 70.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.903 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.7 p -61.39 -38.16 86.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.133 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.468 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 9.4 mmp_? -65.26 -33.65 76.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.888 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -77.34 -49.04 15.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.15 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' A' ' 716' ' ' GLU . 8.5 pt-20 -58.2 -44.44 88.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.865 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . 0.446 ' N ' ' CG ' ' A' ' 715' ' ' GLU . 5.1 mm-40 -84.51 27.49 0.71 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -104.94 96.9 6.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.901 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 719' ' ' ARG . 17.7 ptt180 -103.69 172.17 6.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.869 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 718' ' ' ARG . 0.1 OUTLIER -34.83 151.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.844 -179.916 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 70.5 p -170.24 173.58 5.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.872 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -116.09 -88.99 1.49 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.494 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 138.13 36.92 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.613 2.209 . . . . 0.0 112.345 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 40.9 t -165.06 144.64 6.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.879 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 67.6 p -172.28 174.56 3.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.818 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.486 -180.0 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.365 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 83.6 p -49.59 -45.55 48.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.888 0.375 . . . . 0.0 110.845 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 41.1 t -82.02 89.31 6.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.862 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . -161.73 66.92 0.25 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.549 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 19.3 m -151.17 133.31 15.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.894 0.378 . . . . 0.0 110.859 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 4.5 m -159.14 149.74 19.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.89 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -151.27 105.97 0.3 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.516 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -89.44 33.55 0.82 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.804 0.335 . . . . 0.0 111.111 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 30.8 mmm-85 -124.87 154.31 41.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.884 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 73.4 mt-10 -125.48 110.37 13.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.864 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 27.9 ttt85 -132.63 141.14 48.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.854 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -119.99 51.52 1.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.122 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 14.9 mm -134.89 89.23 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.14 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 88.8 t -61.05 111.3 3.97 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.635 0.731 . . . . 0.0 111.123 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 165.84 29.63 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.66 2.24 . . . . 0.0 112.317 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 13.8 tp -57.88 -53.43 58.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -51.84 -35.52 44.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.904 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -64.86 -68.01 0.39 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.114 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 14.3 ptt180 -52.12 -41.72 62.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.885 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 663' ' ' MET . . . . . 0.441 ' CE ' ' OE1' ' A' ' 701' ' ' GLU . 6.7 mtt -61.76 -43.27 99.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . 0.427 ' HA ' ' CE ' ' A' ' 664' ' ' LYS . 0.4 OUTLIER -58.44 -41.66 85.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.928 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 81.5 mt-30 -61.23 -54.0 49.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.962 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.5 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 23.2 t80 -56.07 -45.19 79.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 6.0 ttpt -66.84 -36.47 82.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.919 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -60.33 -46.91 88.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.849 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.8 ptt? -69.2 -36.84 77.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 36.2 mt -56.4 -44.28 80.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.926 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 54.0 tp -76.34 -54.71 6.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.86 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.08 -61.9 1.95 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -48.07 -19.51 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.904 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 81.83 41.17 9.88 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.473 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 77.1 t -65.1 100.81 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.854 0.359 . . . . 0.0 111.151 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 58.2 m -52.22 148.07 6.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.873 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . 0.452 ' CA ' HG12 ' A' ' 710' ' ' VAL . . . -84.04 -39.34 19.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.126 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -82.69 43.91 0.87 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.8 m -130.86 -175.8 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.844 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 3.3 t -109.72 162.74 14.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.12 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.483 ' CH2' ' HB3' ' A' ' 702' ' ' ARG . 35.1 t-105 -65.37 -27.31 68.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.941 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -59.44 -60.17 4.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.924 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 22.6 mtpt -55.23 -59.0 5.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.913 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -54.8 -41.9 71.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.868 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.447 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 6.1 tp -50.66 -55.22 17.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.546 ' C ' ' CD2' ' A' ' 686' ' ' HIS . 1.1 p-80 -60.05 -35.03 74.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.844 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.544 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 22.2 mttp -67.53 -23.04 65.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.899 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 6.9 pt -116.73 6.47 7.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.072 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 9.0 p -70.93 -24.69 24.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.111 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.527 ' CD1' ' C ' ' A' ' 690' ' ' PHE . 2.4 p90 -87.98 -13.25 42.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.885 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.43 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.6 t70 -77.4 139.87 64.33 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.643 0.735 . . . . 0.0 110.824 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.43 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.0 Cg_endo -69.76 -34.16 15.13 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.684 2.256 . . . . 0.0 112.336 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.448 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 82.0 mtm180 -65.83 -16.1 63.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.858 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.432 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 33.0 t80 -70.0 -7.69 42.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.918 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 15.1 mt -118.13 12.14 13.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.907 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.448 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 90.6 mt -93.59 -23.26 18.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . . . . . . . . . 30.8 mt -114.83 144.93 42.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -50.06 162.05 0.52 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.635 0.731 . . . . 0.0 110.9 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -31.1 21.07 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.659 2.239 . . . . 0.0 112.345 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 37.3 mtpt -72.16 -45.46 60.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.441 ' OE1' ' CE ' ' A' ' 663' ' ' MET . 18.8 mm-40 -60.12 -52.95 63.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.878 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.5 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 10.4 mtp180 -35.3 -48.64 0.47 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.839 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.27 -47.26 62.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.928 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -56.66 -60.77 3.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 94.2 t -55.31 -38.88 49.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.137 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -62.93 -37.26 86.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.851 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -64.76 -58.01 7.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.845 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . 0.462 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 10.4 pt20 -53.87 -37.02 63.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.925 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.462 ' N ' ' HG3' ' A' ' 708' ' ' GLN . 2.6 t80 -63.87 -43.3 96.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . 0.452 HG12 ' CA ' ' A' ' 677' ' ' ALA . 69.6 t -67.65 -45.08 85.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.104 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -53.25 -48.96 67.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.903 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.99 -34.77 77.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.168 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -66.79 -24.44 66.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.901 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -86.47 -46.77 9.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.071 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' A' ' 717' ' ' GLU . 10.9 pt-20 -58.12 -41.93 84.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.9 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -40.53 -27.93 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.834 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' A' ' 715' ' ' GLU . 6.8 mp0 -83.07 98.11 9.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 54.4 mtm180 -130.77 150.48 51.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.896 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.11 113.4 9.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.88 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 58.1 m -107.74 95.99 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.852 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -76.49 -82.75 0.51 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.515 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 154.72 67.15 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.613 2.209 . . . . 0.0 112.37 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 37.9 p -45.19 113.82 0.64 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.79 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 67.5 m -59.78 134.25 56.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.905 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.47 -179.98 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.521 -0.232 . . . . 0.0 112.521 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 29.6 m -162.85 174.21 12.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.879 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 56.4 m -129.71 -47.13 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.861 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 92.92 129.96 5.26 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.476 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 90.1 p -135.0 122.73 22.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.858 0.361 . . . . 0.0 110.836 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 85.8 p -154.3 164.77 38.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.829 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 167.43 84.41 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.478 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -50.93 106.41 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.741 0.305 . . . . 0.0 111.089 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 14.2 mtm105 -125.81 92.69 3.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -52.8 -43.0 65.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.88 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 -80.81 155.47 26.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.856 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -117.7 55.59 0.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.097 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 61.3 mt -114.23 95.69 4.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.121 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 12.4 p -56.17 125.21 63.69 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.624 0.726 . . . . 0.0 111.096 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 160.8 48.35 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.733 2.289 . . . . 0.0 112.336 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . 0.4 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 15.7 tp -56.03 -48.08 76.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.927 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -54.69 -37.01 65.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -66.54 -69.78 0.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.05 179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . 0.4 ' NE ' ' HA ' ' A' ' 659' ' ' LEU . 6.8 ptt180 -49.35 -45.39 45.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.91 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.5 mtt -60.87 -45.09 95.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 1.3 mmmm -55.05 -44.03 74.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -60.48 -62.08 2.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.939 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.57 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 20.9 t80 -49.12 -53.02 22.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 35.0 tttt -54.6 -45.6 73.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -51.71 -44.52 63.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.89 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.4 ' O ' ' C ' ' A' ' 670' ' ' LEU . 8.4 mtm -62.3 -63.35 1.26 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.906 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 669' ' ' MET . 49.2 mt -38.49 -40.69 0.59 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 54.8 tp -75.9 -56.12 4.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . 0.475 ' O ' ' N ' ' A' ' 674' ' ' GLY . 8.2 mm-40 -59.23 -65.74 0.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . 0.407 ' HA ' ' NE ' ' A' ' 673' ' ' ARG . 14.1 mmp_? -39.22 -26.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.854 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . 0.475 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 86.44 34.61 11.71 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.503 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . 0.454 ' CG1' ' HG3' ' A' ' 684' ' ' GLU . 76.7 t -60.29 99.07 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.868 0.366 . . . . 0.0 111.087 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 4.1 m -49.47 151.11 1.66 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -83.68 -26.69 29.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.103 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -102.01 48.12 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -123.97 -175.0 3.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.889 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 40.0 p -107.85 148.43 29.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.1 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.411 ' CZ2' HD11 ' A' ' 685' ' ' LEU . 31.2 t-105 -59.56 -29.13 67.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -63.73 -53.69 47.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.831 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . 0.506 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 10.8 mtpp -58.79 -59.06 6.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . 0.454 ' HG3' ' CG1' ' A' ' 675' ' ' VAL . 64.6 mm-40 -55.32 -37.02 66.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.411 HD11 ' CZ2' ' A' ' 681' ' ' TRP . 4.9 tp -54.53 -63.18 1.23 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.506 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 5.6 p-80 -56.86 -29.26 62.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.809 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -68.13 -32.08 72.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.932 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 11.2 pt -112.78 9.94 8.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.108 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 7.9 p -70.02 -24.66 26.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.131 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 10.4 p90 -80.08 -51.9 8.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.869 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.574 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 7.6 t70 -34.0 140.09 0.26 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.591 0.71 . . . . 0.0 110.904 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.43 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.67 -38.33 8.15 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.699 2.266 . . . . 0.0 112.357 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.46 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 28.7 mtm180 -65.56 -25.04 67.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.87 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.407 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 19.4 t80 -58.24 -11.59 2.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.897 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 30.9 mt -114.14 25.59 10.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.938 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.46 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 95.9 mt -109.52 -28.46 8.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.459 ' CD1' ' HB2' ' A' ' 666' ' ' PHE . 32.1 mt -103.21 139.37 38.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.971 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -48.5 162.62 0.35 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.598 0.713 . . . . 0.0 110.946 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -35.43 12.72 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.672 2.248 . . . . 0.0 112.348 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -72.15 -42.47 65.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.918 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 702' ' ' ARG . 26.4 mt-10 -60.0 -51.47 69.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.57 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 40.5 mtp180 -37.93 -51.04 1.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.871 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -66.09 -46.83 76.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.877 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -56.28 -61.06 2.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.882 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 84.6 t -56.19 -41.54 70.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.097 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 21.9 t80 -60.32 -44.08 95.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.908 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -58.12 -48.07 81.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.853 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -61.11 -45.18 95.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.917 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.508 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 5.5 t80 -55.92 -44.95 78.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 90.3 t -62.87 -51.91 65.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.134 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -45.98 -48.38 16.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.899 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.2 p -65.28 -46.54 80.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.145 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.508 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 12.5 mmp_? -59.22 -21.06 58.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -86.42 -59.97 2.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.045 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -46.23 -35.19 4.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.851 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . 0.438 ' O ' ' N ' ' A' ' 718' ' ' ARG . 5.5 mm-40 -87.89 30.49 0.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.879 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -53.47 88.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . 0.438 ' N ' ' O ' ' A' ' 716' ' ' GLU . 12.7 mmm-85 -98.54 161.69 13.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.857 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -114.53 -48.9 2.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 39.8 t -116.64 148.64 40.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.866 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 107.34 146.23 12.73 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.488 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 144.53 54.1 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.671 2.247 . . . . 0.0 112.349 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 2.8 t -102.33 -44.76 5.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.905 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 88.0 p -82.12 81.29 8.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.838 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.519 179.997 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 7.3 m -65.53 152.44 44.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.92 0.39 . . . . 0.0 110.837 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 57.9 m -103.02 86.48 2.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.873 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 70.68 -144.64 38.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.482 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 58.4 m 38.65 50.05 1.54 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.889 0.376 . . . . 0.0 110.861 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 8.2 t -120.3 104.64 10.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.834 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 98.7 67.95 0.9 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.482 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -96.43 103.59 15.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.779 0.323 . . . . 0.0 111.09 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -135.77 111.85 9.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.864 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -85.21 41.69 0.9 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.875 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -73.19 91.82 1.69 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.891 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -85.97 37.19 0.7 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.107 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . 0.408 HD11 ' N ' ' A' ' 656' ' ' ILE . 5.3 mp -111.83 102.93 14.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.134 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 92.4 t -95.02 123.41 57.47 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.598 0.714 . . . . 0.0 111.178 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 159.98 51.38 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.708 2.272 . . . . 0.0 112.331 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 17.5 tp -57.81 -46.8 84.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -55.81 -32.17 63.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.92 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -70.84 -66.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.122 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -51.91 -48.84 63.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.913 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 9.1 mtt -57.52 -48.52 79.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.935 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -51.22 -44.71 61.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -59.24 -60.53 3.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.931 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -47.72 -59.9 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.88 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -46.24 -50.93 15.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.887 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -48.91 -48.14 42.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 3.8 mtm -56.37 -62.37 1.76 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.907 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 49.4 mt -41.23 -38.72 1.18 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 20.8 tp -72.52 -47.33 49.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.921 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . 0.425 ' O ' ' C ' ' A' ' 673' ' ' ARG . 12.3 mm-40 -71.69 -66.02 0.69 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.872 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 672' ' ' GLU . 13.2 mmt-85 -36.26 -39.26 0.17 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.875 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 100.01 29.61 6.75 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.531 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . 0.42 ' O ' ' C ' ' A' ' 676' ' ' SER . 19.4 t -59.57 87.54 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.877 0.37 . . . . 0.0 111.126 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 676' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 675' ' ' VAL . 50.8 m -37.15 155.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.861 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -100.11 -4.82 28.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.06 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -117.03 36.3 4.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.889 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.1 m -125.13 -177.02 3.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.841 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 2.8 p -94.14 153.52 18.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.156 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.56 ' CZ2' HD12 ' A' ' 685' ' ' LEU . 29.1 t-105 -63.09 -30.56 71.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.879 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.33 -57.17 13.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 9.2 mttp -56.2 -59.09 5.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . 0.509 ' OE1' ' CZ ' ' A' ' 706' ' ' PHE . 8.1 mt-10 -55.4 -43.75 75.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.918 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.56 HD12 ' CZ2' ' A' ' 681' ' ' TRP . 6.4 tp -47.35 -61.75 1.76 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.515 ' CD2' ' N ' ' A' ' 687' ' ' LYS . 1.8 p-80 -56.32 -35.36 67.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.859 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.515 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 13.4 mtmt -63.67 -25.47 68.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.867 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 13.7 pt -121.07 11.84 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.143 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 3.3 p -80.29 -34.68 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.11 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.448 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 4.8 p90 -67.15 -43.28 82.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.906 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.448 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.5 t70 -46.58 139.72 6.11 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.563 0.696 . . . . 0.0 110.848 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.1 Cg_endo -69.74 -42.0 3.81 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.705 2.27 . . . . 0.0 112.318 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 19.6 mtm-85 -56.71 -23.57 43.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.567 ' CE2' ' HD3' ' A' ' 702' ' ' ARG . 0.8 OUTLIER -65.72 -30.12 70.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.911 -179.859 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.417 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 35.7 mt -78.73 -6.46 55.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.889 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.88 -52.74 10.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.451 ' O ' ' NH2' ' A' ' 702' ' ' ARG . 11.7 mt -78.21 156.62 29.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -68.64 164.05 48.92 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.645 0.736 . . . . 0.0 110.857 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -35.41 12.73 Favored 'Trans proline' 0 N--CA 1.465 -0.176 0 C-N-CA 122.717 2.278 . . . . 0.0 112.38 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -72.44 -45.65 58.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.892 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.478 ' N ' ' CD ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -60.44 -53.47 57.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.567 ' HD3' ' CE2' ' A' ' 694' ' ' TYR . 68.7 mtt180 -34.49 -46.65 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.899 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 4.4 tmtm? -72.15 -46.23 57.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.841 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -56.26 -55.93 27.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.75 -48.41 81.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.158 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . 0.509 ' CZ ' ' OE1' ' A' ' 684' ' ' GLU . 19.2 t80 -55.43 -45.48 76.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.906 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -55.66 -47.7 76.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.845 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -64.53 -40.86 96.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.908 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.518 ' CZ ' ' HG3' ' A' ' 713' ' ' ARG . 11.7 t80 -63.95 -46.13 86.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.889 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . 0.482 ' CG2' ' CE1' ' A' ' 706' ' ' PHE . 68.9 t -63.71 -48.92 84.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.092 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -51.89 -45.52 64.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -41.07 69.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.147 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.518 ' HG3' ' CZ ' ' A' ' 709' ' ' TYR . 4.7 mmp_? -59.23 -33.32 70.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.908 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -81.63 -55.01 4.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.095 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -56.07 -19.15 11.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.894 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . 0.424 ' O ' ' N ' ' A' ' 718' ' ' ARG . 8.0 tt0 -103.01 28.85 5.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.926 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -60.81 80.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.897 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . 0.424 ' N ' ' O ' ' A' ' 716' ' ' GLU . 4.0 ptt85 -91.3 138.58 31.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.868 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -94.27 142.27 27.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.855 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 40.2 t -79.25 156.04 28.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.859 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -133.42 -86.49 0.28 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.465 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -42.66 3.27 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.684 2.256 . . . . 0.0 112.331 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 97.5 p -76.02 156.88 33.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.852 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 44.6 m -126.68 135.26 50.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.847 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.514 -179.974 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.466 -0.254 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 19.4 t -89.68 135.92 33.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.852 0.358 . . . . 0.0 110.843 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 25.1 p -105.68 118.07 35.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.856 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . -154.12 158.34 28.08 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.488 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 3.4 m -158.78 139.58 12.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.833 0.349 . . . . 0.0 110.89 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 2.3 m -78.66 105.76 10.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.858 -179.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 108.49 122.16 4.65 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.45 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -109.22 115.58 30.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.736 0.303 . . . . 0.0 111.116 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -44.51 -42.06 6.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.86 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -131.65 175.08 9.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.854 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 24.5 mmm180 -106.99 -19.13 13.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.875 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -96.67 36.18 1.42 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.105 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 95.1 mt -130.03 113.16 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.124 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 10.6 p -120.41 126.53 26.73 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.596 0.713 . . . . 0.0 111.13 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . 0.417 ' HG2' ' CB ' ' A' ' 661' ' ' ALA . 53.9 Cg_endo -69.71 159.03 54.95 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.691 2.261 . . . . 0.0 112.335 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 43.0 tp -59.42 -49.43 77.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -52.97 -36.58 60.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . 0.417 ' CB ' ' HG2' ' A' ' 658' ' ' PRO . . . -68.69 -69.49 0.32 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.119 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -47.72 -53.27 15.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 663' ' ' MET . . . . . 0.44 ' HA ' ' CD1' ' A' ' 697' ' ' LEU . 11.4 mtt -53.24 -44.4 68.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.933 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -31.87 70.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -67.45 -59.32 3.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.528 ' CD1' ' HE2' ' A' ' 669' ' ' MET . 26.5 t80 -55.03 -55.82 26.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.889 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.8 -44.31 73.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.865 -179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -52.15 -52.75 49.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.859 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.528 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 3.0 ptt? -67.73 -39.09 84.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.908 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 24.9 mt -47.52 -46.98 28.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.925 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.7 tp -79.62 -48.2 14.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . 0.433 ' O ' ' N ' ' A' ' 674' ' ' GLY . 27.9 mm-40 -55.6 -66.02 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.897 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 9.1 mmp_? -42.76 -23.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.872 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 87.33 43.99 5.72 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.485 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . 0.456 HG12 ' CG ' ' A' ' 684' ' ' GLU . 87.9 t -71.25 101.42 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.861 0.363 . . . . 0.0 111.18 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 3.2 t -61.35 154.93 22.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.891 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -87.3 -47.88 8.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.089 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -58.56 -27.06 64.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 39.2 m -65.96 167.55 9.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 30.3 p -92.29 163.34 13.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.14 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 4.4 t-105 -67.31 -31.5 71.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.923 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -58.83 -56.9 16.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.846 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -56.52 -59.03 5.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.934 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . 0.456 ' CG ' HG12 ' A' ' 675' ' ' VAL . 63.1 mm-40 -53.94 -40.68 67.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 5.7 tp -52.09 -59.12 4.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.932 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.521 ' CD2' ' N ' ' A' ' 687' ' ' LYS . 1.6 p-80 -56.49 -33.31 65.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.83 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 48.0 mttt -65.56 -31.7 72.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 12.5 pt -112.83 11.07 8.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.11 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 4.3 p -76.69 -32.9 21.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.171 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -74.99 -28.66 60.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.879 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.429 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 11.6 t70 -63.4 139.81 97.63 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.585 0.707 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.2 Cg_endo -69.77 -40.63 5.08 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.703 2.269 . . . . 0.0 112.324 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 36.7 mtm180 -57.99 -22.14 48.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.834 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.637 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 11.6 t80 -67.13 -3.56 7.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.94 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 28.2 mt -111.49 -13.95 13.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.904 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.56 -46.05 90.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.928 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.44 ' CD1' ' HA ' ' A' ' 663' ' ' MET . 30.1 mt -93.68 140.54 29.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -48.87 162.81 0.36 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.599 0.714 . . . . 0.0 110.924 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . 0.444 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.6 Cg_endo -69.76 -32.18 19.07 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.738 2.292 . . . . 0.0 112.338 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -72.23 -46.92 54.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.861 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.0 -49.84 75.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.879 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.637 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 56.8 mtm180 -42.66 -43.5 3.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.87 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -71.2 -42.86 68.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.903 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -60.4 -57.31 13.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 74.5 t -56.91 -43.69 80.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.118 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . 0.412 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 20.9 t80 -61.74 -43.39 98.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.891 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -55.59 -49.0 73.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -63.47 -38.05 89.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.593 ' C ' ' CD1' ' A' ' 709' ' ' TYR . 0.3 OUTLIER -66.69 -38.15 86.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.927 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . 0.412 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 99.4 t -72.98 -53.7 17.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.137 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -49.42 -51.61 34.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.888 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 10.6 p -66.25 -36.56 83.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.15 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.56 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 9.9 mmm180 -66.02 -34.35 77.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.884 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -75.67 -52.19 11.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.082 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . 0.413 ' CG ' ' N ' ' A' ' 716' ' ' GLU . 9.1 pt-20 -54.33 -42.5 70.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.872 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . 0.443 ' O ' ' C ' ' A' ' 717' ' ' GLU . 13.0 mt-10 -84.16 23.87 1.01 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 716' ' ' GLU . 11.7 pt-20 -34.32 128.96 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 18.0 mtp85 -117.73 115.9 25.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.85 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -71.97 102.51 2.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.873 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 4.2 t 66.83 41.15 2.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.819 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -71.59 -159.09 3.6 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.482 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 161.19 46.9 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.657 2.238 . . . . 0.0 112.381 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 50.3 p -112.29 -44.0 3.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.839 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 37.1 p -99.17 152.71 19.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.807 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.491 179.99 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 N-CA-C 112.446 -0.261 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 37.0 t -110.76 104.17 12.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.875 0.369 . . . . 0.0 110.896 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 50.6 p -80.19 149.7 30.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.915 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . -142.55 63.71 0.5 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.471 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 36.4 p -103.49 116.77 33.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.844 0.354 . . . . 0.0 110.852 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 46.6 t -73.66 143.67 46.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.864 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -67.43 -136.64 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.505 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -137.11 165.53 25.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.815 0.341 . . . . 0.0 111.103 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 88.2 mtt-85 -118.63 -55.15 2.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -118.68 151.44 37.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -112.32 130.33 55.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.85 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -116.0 178.76 4.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.081 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 51.8 mt -90.71 93.85 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.15 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . 0.431 ' HB ' ' CB ' ' A' ' 661' ' ' ALA . 2.9 m -61.42 151.78 75.87 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.632 0.73 . . . . 0.0 111.146 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . 0.445 ' O ' ' N ' ' A' ' 661' ' ' ALA . 54.1 Cg_endo -69.76 149.19 66.59 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.721 2.281 . . . . 0.0 112.345 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 21.4 tp -44.25 -36.56 2.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.933 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -71.24 -31.72 67.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.882 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . 0.445 ' N ' ' O ' ' A' ' 658' ' ' PRO . . . -66.25 -55.79 14.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.121 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . 0.459 ' HB2' ' CD2' ' A' ' 697' ' ' LEU . 0.0 OUTLIER -60.22 -54.87 40.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.869 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 16.1 mtt -51.05 -47.6 61.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.887 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.54 -45.43 73.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.921 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -59.69 -50.63 73.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.898 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.446 ' O ' ' CG ' ' A' ' 669' ' ' MET . 30.9 t80 -57.74 -58.98 5.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -51.14 -37.69 47.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.891 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -58.24 -52.52 65.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.852 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.456 ' HB3' ' CZ ' ' A' ' 693' ' ' ARG . 2.8 ptt? -67.31 -35.82 80.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.909 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 20.0 mt -52.45 -52.56 53.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.93 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 13.2 tp -78.09 -43.16 29.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -55.31 -65.63 0.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.903 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 10.2 mmp_? -45.86 -26.14 0.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 92.12 38.36 5.72 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.518 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 42.0 t -61.06 112.47 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 111.17 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 16.1 m -70.22 127.51 33.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.878 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -67.97 -53.35 26.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.124 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . 0.455 ' CZ ' ' OE2' ' A' ' 717' ' ' GLU . 74.3 m-85 -51.59 -32.32 28.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.934 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.3 m -62.08 -178.69 0.17 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.804 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 16.9 p -102.5 167.31 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.104 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.464 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 32.6 t-105 -66.9 -24.75 66.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.913 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -64.0 -63.12 1.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.916 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.01 -58.97 4.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -56.67 -44.63 81.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.866 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.464 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.4 tp -48.22 -50.49 29.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.982 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.577 ' CD2' ' N ' ' A' ' 687' ' ' LYS . 1.2 p-80 -65.9 -33.87 76.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.577 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 51.7 mttt -65.94 -23.6 66.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.832 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 7.2 pt -117.8 3.17 7.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.182 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 7.9 p -68.2 -33.13 58.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.099 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -84.26 5.29 27.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.876 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.488 ' OD1' ' N ' ' A' ' 693' ' ' ARG . 4.7 t70 -92.72 142.63 25.91 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.625 0.726 . . . . 0.0 110.862 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.9 Cg_endo -69.72 -47.84 0.86 Allowed 'Trans proline' 0 N--CA 1.465 -0.197 0 C-N-CA 122.705 2.27 . . . . 0.0 112.385 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.488 ' N ' ' OD1' ' A' ' 691' ' ' ASP . 79.1 mtm180 -53.07 -25.29 12.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.469 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 19.6 t80 -65.66 -5.23 7.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.923 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 30.8 mt -118.05 10.95 13.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.905 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.434 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 94.1 mt -94.12 -31.79 14.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.459 ' CD2' ' HB2' ' A' ' 662' ' ' ARG . 40.1 mt -102.56 141.09 35.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.969 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 -47.5 162.36 0.3 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.667 0.746 . . . . 0.0 110.853 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . 0.402 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.0 Cg_endo -69.72 -34.16 15.27 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.651 2.234 . . . . 0.0 112.374 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -72.27 -44.56 62.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.461 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -62.02 -49.64 75.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.432 ' NH1' ' O ' ' A' ' 694' ' ' TYR . 43.3 mtm180 -42.7 -44.69 4.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.903 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 7.7 tppt? -69.3 -46.33 67.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -57.03 -55.07 39.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.881 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.6 t -58.68 -37.47 65.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.105 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 75.0 t80 -67.27 -34.6 77.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -64.7 -54.22 34.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.883 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . 0.461 ' CG ' ' N ' ' A' ' 709' ' ' TYR . 7.6 pt20 -57.84 -45.38 86.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.941 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.693 ' CD2' ' CZ ' ' A' ' 713' ' ' ARG . 2.7 t80 -56.99 -52.71 64.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.922 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 92.3 t -59.66 -39.23 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.168 179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -53.54 -51.25 63.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.967 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 712' ' ' THR . . . . . 0.436 ' O ' ' N ' ' A' ' 714' ' ' ALA . 20.3 p -70.03 -67.12 0.51 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.156 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.693 ' CZ ' ' CD2' ' A' ' 709' ' ' TYR . 10.4 mpt_? -42.34 -23.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.869 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 712' ' ' THR . . . -90.22 -54.52 3.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.1 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -30.02 62.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.87 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -87.35 22.12 2.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . 0.455 ' OE2' ' CZ ' ' A' ' 678' ' ' PHE . 4.7 tp10 -45.58 116.59 1.21 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.869 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . 0.452 ' C ' ' O ' ' A' ' 717' ' ' GLU . 11.7 ttt180 -34.29 122.69 0.5 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.895 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 22.8 ttp180 -77.96 153.71 32.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.866 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 3.2 t -75.98 -59.09 2.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.853 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -48.32 157.66 0.93 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.445 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 127.71 14.98 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.647 2.231 . . . . 0.0 112.355 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 2.5 t -95.81 -47.42 6.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.863 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 54.7 p -107.48 160.09 15.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.891 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.3 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.454 179.988 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.467 -0.253 . . . . 0.0 112.467 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 2.2 m -81.4 170.92 15.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.876 0.369 . . . . 0.0 110.858 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 74.4 m -103.29 -43.65 5.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.867 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 103.86 -173.52 21.77 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.505 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 80.5 p -164.22 174.05 11.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.925 0.393 . . . . 0.0 110.868 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 46.9 p -138.92 122.94 17.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.826 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 60.11 58.74 12.51 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.465 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -104.77 126.77 52.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.807 0.337 . . . . 0.0 111.081 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.92 150.07 49.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.9 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -110.88 39.33 2.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.902 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 51.8 mtm180 -71.3 -52.53 18.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.856 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -42.79 156.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.088 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . 0.421 ' N ' HD13 ' A' ' 656' ' ' ILE . 5.0 mp -96.92 94.61 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.128 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 82.5 t -52.01 127.84 37.15 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.629 0.728 . . . . 0.0 111.137 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . 0.403 ' HG2' ' CB ' ' A' ' 661' ' ' ALA . 53.5 Cg_endo -69.75 158.18 57.85 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.712 2.274 . . . . 0.0 112.3 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 25.6 tp -56.07 -47.29 78.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . 0.432 ' HG3' ' N ' ' A' ' 661' ' ' ALA . 8.1 pt-20 -56.35 -36.0 68.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . 0.432 ' N ' ' HG3' ' A' ' 660' ' ' GLU . . . -68.39 -71.04 0.23 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.105 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -46.92 -48.96 21.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.839 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.4 mtt -55.25 -49.09 72.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.859 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.71 -48.23 50.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.939 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -56.7 -61.21 2.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.901 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . 0.55 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 21.2 t80 -43.53 -60.62 1.67 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -51.04 -47.71 61.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.902 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -50.18 -41.15 48.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.915 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 4.4 mtm -65.4 -63.42 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.864 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 57.3 mt -39.38 -40.11 0.76 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.919 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 19.8 tp -76.64 -45.9 28.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.928 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -65.22 -62.77 1.34 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -46.23 -21.81 0.19 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.898 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 84.29 42.68 7.36 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.506 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . . . . . . . . . 37.3 t -70.01 100.61 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.837 0.351 . . . . 0.0 111.115 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 20.3 m -56.2 141.22 41.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.843 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -77.85 -37.87 47.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.07 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -81.47 44.92 0.83 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.902 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.7 m -133.67 -177.2 4.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.896 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 5.2 t -99.1 154.14 18.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.154 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.48 ' CZ2' HD11 ' A' ' 685' ' ' LEU . 3.3 t-105 -65.47 -32.63 74.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -57.97 -48.89 78.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.918 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 32.4 mttm -62.85 -59.02 5.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.909 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -55.76 -37.3 68.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.48 HD11 ' CZ2' ' A' ' 681' ' ' TRP . 8.0 tp -56.58 -62.94 1.38 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.919 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.582 ' CD2' ' N ' ' A' ' 687' ' ' LYS . 2.1 p-80 -51.72 -36.01 45.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.582 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 37.5 mttm -64.26 -33.47 75.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.918 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 23.9 pt -108.09 10.06 9.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.092 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 3.3 p -78.17 -11.71 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.115 179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.424 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 11.4 p90 -90.49 -41.61 11.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.879 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.424 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 10.6 t70 -53.59 139.8 48.77 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.595 0.712 . . . . 0.0 110.875 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.8 Cg_endo -69.76 -42.49 3.35 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.659 2.239 . . . . 0.0 112.372 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.452 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 22.4 mtm-85 -53.41 -20.66 4.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.897 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.576 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 40.3 t80 -63.3 -25.56 68.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.884 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 28.6 mt -85.73 -20.26 29.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.944 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.452 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 78.8 mt -59.27 -47.65 84.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.967 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.449 HD12 ' CB ' ' A' ' 666' ' ' PHE . 10.8 mt -85.18 145.1 27.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.884 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -60.55 164.16 7.65 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.646 0.736 . . . . 0.0 110.861 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.67 -34.05 15.66 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.642 2.228 . . . . 0.0 112.394 179.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -72.38 -47.03 52.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.414 ' O ' ' C ' ' A' ' 702' ' ' ARG . 6.0 mm-40 -61.46 -54.17 46.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.821 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.576 ' NH1' ' CE2' ' A' ' 694' ' ' TYR . 30.6 mtm180 -37.1 -45.04 0.58 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.924 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 3.2 tppt? -70.27 -45.8 65.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.924 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -60.84 -58.98 6.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.887 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 44.1 t -50.68 -52.54 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.146 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . 0.416 ' CZ ' HG22 ' A' ' 710' ' ' VAL . 20.2 t80 -51.1 -55.14 19.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.858 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -45.49 -51.18 12.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -60.63 -44.42 96.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.939 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.459 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 1.5 t80 -56.97 -42.63 80.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.951 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . 0.416 HG22 ' CZ ' ' A' ' 706' ' ' PHE . 85.0 t -66.3 -39.3 83.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.137 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 46.9 tttt -58.82 -41.34 86.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.87 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.8 p -73.74 -41.68 62.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.469 ' HA ' ' CZ ' ' A' ' 713' ' ' ARG . 0.1 OUTLIER -66.3 -27.0 67.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.861 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -83.69 -52.77 6.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.102 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -53.19 -41.91 65.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -46.71 -21.5 0.2 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.869 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.6 110.04 3.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.884 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -40.63 140.19 0.71 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.848 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -97.38 129.79 44.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 80.1 p -91.68 151.99 20.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.86 -179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -117.72 146.23 18.63 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.517 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -12.14 32.26 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.689 2.259 . . . . 0.0 112.336 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 15.9 m -72.93 113.92 10.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.864 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 32.8 t -41.76 161.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.865 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.274 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.482 -179.964 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 N-CA-C 112.512 -0.235 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 23.2 t -115.71 134.88 54.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.872 0.368 . . . . 0.0 110.848 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 20.1 t -169.28 113.78 0.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.855 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 166.14 122.76 0.62 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.492 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 69.3 m -151.18 147.87 27.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.902 0.382 . . . . 0.0 110.853 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 78.3 p -121.73 160.66 24.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.88 -179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 38.76 88.68 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.5 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -117.48 98.63 6.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 111.095 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -122.31 47.92 1.83 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.861 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -92.82 72.36 4.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 30.0 ttt180 -67.95 -61.24 1.96 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -106.38 46.08 0.94 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 94.0 mt -138.8 109.88 5.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.08 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 75.6 t -121.11 81.89 36.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.642 0.734 . . . . 0.0 111.133 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 161.72 44.85 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.746 2.297 . . . . 0.0 112.33 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 36.2 tp -53.48 -47.35 69.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.912 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 660' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 1.5 mp0 -56.53 -34.2 66.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.874 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.97 -67.93 0.43 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.046 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -48.62 -55.69 10.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.921 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.9 mtt -54.15 -47.18 72.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.867 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 664' ' ' LYS . . . . . 0.439 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 11.7 mmmt -51.18 -48.88 61.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.869 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -56.44 -60.72 3.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.933 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 666' ' ' PHE . . . . . . . . . . . . . 19.3 t80 -46.41 -62.01 1.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 57.5 tttt -47.55 -49.18 27.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.914 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -47.62 -49.63 26.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.867 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 669' ' ' MET . . . . . 0.454 ' O ' ' N ' ' A' ' 672' ' ' GLU . 4.6 mtm -59.07 -64.51 0.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.849 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 670' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' A' ' 669' ' ' MET . 50.4 mt -37.54 -41.7 0.48 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.916 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 23.4 tp -76.8 -38.76 53.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.909 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 672' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' A' ' 669' ' ' MET . 5.7 mm-40 -73.29 -65.98 0.74 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.888 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 673' ' ' ARG . . . . . 0.433 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 5.4 mmp_? -39.63 -33.91 0.21 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.837 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 97.89 25.09 10.87 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.48 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 675' ' ' VAL . . . . . 0.423 HG12 ' CD ' ' A' ' 684' ' ' GLU . 39.8 t -51.82 97.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.84 0.353 . . . . 0.0 111.103 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 43.4 m -54.75 132.14 45.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -64.95 -47.55 77.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.098 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -76.85 48.02 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.867 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.3 t -130.84 176.61 8.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.901 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 61.1 p -94.51 142.1 27.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.107 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 681' ' ' TRP . . . . . 0.512 ' CE3' ' CD2' ' A' ' 706' ' ' PHE . 34.9 t-105 -57.12 -31.65 65.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.964 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -60.32 -56.01 26.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.881 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 683' ' ' LYS . . . . . 0.54 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 44.6 mttt -57.99 -59.01 5.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.908 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 684' ' ' GLU . . . . . 0.423 ' CD ' HG12 ' A' ' 675' ' ' VAL . 21.6 mm-40 -56.04 -41.04 74.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.898 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 685' ' ' LEU . . . . . 0.436 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 9.4 tp -50.63 -58.88 4.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.935 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 686' ' ' HIS . . . . . 0.54 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 3.8 p-80 -60.62 -29.96 69.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.86 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 687' ' ' LYS . . . . . 0.418 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 66.4 mttt -67.03 -27.59 67.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.943 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 13.1 pt -117.97 8.3 6.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.104 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 4.0 p -74.84 -28.36 21.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.157 179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 690' ' ' PHE . . . . . 0.465 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 13.6 p90 -73.49 -44.53 57.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.845 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 691' ' ' ASP . . . . . 0.465 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.8 t70 -40.82 139.77 1.14 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.627 0.727 . . . . 0.0 110.861 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.77 -39.17 6.8 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.679 2.253 . . . . 0.0 112.339 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 693' ' ' ARG . . . . . 0.467 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 79.4 mtm180 -61.36 -27.19 68.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.809 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 694' ' ' TYR . . . . . 0.519 ' CD1' ' C ' ' A' ' 694' ' ' TYR . 1.4 t80 -62.7 -23.62 67.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.923 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.407 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 20.2 mt -91.17 9.26 31.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.953 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 696' ' ' LEU . . . . . 0.467 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 89.6 mt -89.77 -40.84 12.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 697' ' ' LEU . . . . . 0.449 ' O ' ' NH2' ' A' ' 702' ' ' ARG . 60.7 mt -91.97 166.0 12.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.894 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 698' ' ' ASN . . . . . 0.503 ' ND2' ' OE2' ' A' ' 701' ' ' GLU . 0.2 OUTLIER -78.58 165.39 50.1 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.623 0.725 . . . . 0.0 110.89 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 -26.11 27.88 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.725 2.283 . . . . 0.0 112.353 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -72.47 -47.8 45.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.915 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 701' ' ' GLU . . . . . 0.503 ' OE2' ' ND2' ' A' ' 698' ' ' ASN . 0.0 OUTLIER -66.17 -52.75 45.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.887 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 702' ' ' ARG . . . . . 0.449 ' NH2' ' O ' ' A' ' 697' ' ' LEU . 79.8 mtt180 -35.13 -44.66 0.26 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.874 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 19.3 tptp -74.48 -48.76 25.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -55.81 -57.73 10.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.94 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 89.9 t -56.71 -49.86 76.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.112 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 706' ' ' PHE . . . . . 0.512 ' CD2' ' CE3' ' A' ' 681' ' ' TRP . 20.1 t80 -53.22 -41.15 65.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.85 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.37 -46.19 91.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.866 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -61.03 -39.86 91.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.916 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 709' ' ' TYR . . . . . 0.447 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 22.7 t80 -63.06 -43.25 99.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.917 -179.871 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 86.8 t -63.49 -48.93 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.087 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 35.9 tttt -54.11 -48.54 70.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 2.3 p -66.58 -37.25 84.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.159 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 713' ' ' ARG . . . . . 0.447 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.2 mmm180 -66.54 -28.24 68.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -79.18 -54.87 5.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.156 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -55.33 -33.37 63.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.831 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -91.9 26.37 2.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.874 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -49.35 100.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 17.6 mtp180 -109.34 162.99 13.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.867 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -130.95 84.38 2.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.863 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 2.4 t -166.44 163.26 17.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.865 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 67.68 -163.89 46.36 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.515 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -179.54 2.99 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.691 2.261 . . . . 0.0 112.318 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 63.3 p -131.84 133.63 44.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 72.8 m -100.66 150.68 22.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.862 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.496 -179.974 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.514 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.171 0 CA-C-O 120.819 0.258 . . . . 0.0 112.347 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 14.8 tp -56.02 -47.3 78.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -58.01 -33.69 69.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.867 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.514 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -67.45 -67.17 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.104 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.806 ' HG3' HD21 ' A' ' 697' ' ' LEU . 14.9 ptt180 -53.82 -47.22 71.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.849 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.436 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.3 mtt -54.99 -41.35 71.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -61.58 -43.48 98.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -57.47 -57.89 10.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.951 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.635 ' CD1' ' HE2' ' A' ' 669' ' ' MET . 25.1 t80 -51.99 -52.49 50.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.898 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.406 ' HA ' HD12 ' A' ' 670' ' ' LEU . 12.4 ttmt -55.89 -37.21 68.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.905 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.86 -52.16 66.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.838 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.635 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 2.8 ptt? -66.92 -37.46 84.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.454 HD11 ' CE2' ' A' ' 666' ' ' PHE . 29.6 mt -52.25 -48.86 64.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.938 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.8 tp -77.5 -45.75 24.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -57.1 -66.04 0.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 10.4 mmp_? -43.76 -25.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.872 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 89.2 43.84 5.19 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.515 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.452 HG13 ' CG ' ' A' ' 684' ' ' GLU . 40.4 t -68.06 97.87 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.853 0.359 . . . . 0.0 111.128 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 8.7 t -51.42 143.92 10.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.815 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -80.89 -42.08 22.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.133 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -82.94 47.67 1.25 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.885 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.8 m -131.9 -178.62 4.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.856 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 680' ' ' THR . . . . . 0.482 HG23 ' H ' ' A' ' 683' ' ' LYS . 1.7 t -101.7 151.45 22.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.125 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.411 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 26.1 t-105 -59.43 -25.59 64.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.957 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.58 -56.64 14.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.904 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.482 ' H ' HG23 ' A' ' 680' ' ' THR . 38.4 mttp -56.13 -59.04 5.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.882 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.452 ' CG ' HG13 ' A' ' 675' ' ' VAL . 37.7 mm-40 -54.92 -40.6 70.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.908 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.411 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 11.7 tp -51.77 -59.41 4.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.883 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.594 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.1 p-80 -59.2 -29.81 67.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.475 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 45.9 mttm -68.03 -28.12 67.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.849 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 25.3 pt -117.88 10.45 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.113 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.594 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.7 p -74.4 -37.6 45.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.091 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.475 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 7.2 p90 -80.5 9.41 6.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.868 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.423 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 10.0 t70 -93.68 139.81 22.88 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.595 0.712 . . . . 0.0 110.858 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.9 Cg_endo -69.8 -43.06 2.85 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.671 2.247 . . . . 0.0 112.358 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.479 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 70.9 mtm180 -58.47 -21.66 52.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.644 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 1.8 t80 -67.04 -18.69 65.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 12.2 mt -97.29 7.26 46.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.479 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 83.4 mt -91.13 -31.2 16.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.806 HD21 ' HG3' ' A' ' 662' ' ' ARG . 27.2 mt -104.12 152.39 22.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.894 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -57.31 161.86 4.99 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.693 0.758 . . . . 0.0 110.887 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 -37.23 9.52 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.696 2.264 . . . . 0.0 112.362 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -72.1 -45.52 60.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' A' ' 702' ' ' ARG . 36.9 mt-10 -56.95 -53.15 61.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.899 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.644 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 47.5 mtt180 -36.28 -52.24 0.8 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.837 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -65.38 -45.07 85.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -56.35 -57.89 10.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.04 -29.98 42.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.109 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.411 ' O ' HG23 ' A' ' 710' ' ' VAL . 43.1 t80 -71.08 -47.95 55.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -55.89 -52.64 63.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.881 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -60.33 -41.8 94.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.893 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -58.99 -41.22 87.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.858 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 706' ' ' PHE . 78.2 t -68.95 -43.04 82.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.067 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -53.23 -51.25 62.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.894 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 47.3 p -66.74 -35.73 80.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.149 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.409 ' HA ' ' NE ' ' A' ' 713' ' ' ARG . 5.0 mmp_? -66.45 -29.47 69.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.14 179.894 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.401 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.1 Cg_endo . . . . . 0 C--O 1.232 0.195 0 CA-C-O 120.806 0.252 . . . . 0.0 112.335 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 26.4 tp -46.22 -47.58 17.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.933 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -57.65 -35.68 70.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.909 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.401 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -67.68 -70.46 0.26 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.104 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.635 ' HG3' HD21 ' A' ' 697' ' ' LEU . 5.2 ptm180 -46.8 -51.63 16.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.885 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.693 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.1 mtt -56.97 -50.1 73.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.87 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -51.25 -41.83 60.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.899 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -61.49 -65.45 0.69 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.912 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.751 ' HB2' HD12 ' A' ' 697' ' ' LEU . 21.6 t80 -44.81 -49.12 10.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 43.7 tttt -63.22 -42.26 99.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -52.83 -36.39 58.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.41 ' HG2' ' NH1' ' A' ' 693' ' ' ARG . 6.3 mtm -73.81 -60.54 2.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 54.3 mt -39.23 -42.32 0.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.948 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.2 tp -78.46 -50.45 11.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.918 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -59.73 -65.91 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.858 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -41.83 -32.84 0.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.896 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 96.24 31.4 7.24 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.489 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.79 HG13 ' HG2' ' A' ' 684' ' ' GLU . 69.6 t -55.11 103.44 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.874 0.368 . . . . 0.0 111.116 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 59.3 m -59.3 137.51 57.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -72.96 1.6 8.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.092 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -121.86 24.02 9.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.88 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.6 t -105.72 161.95 13.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.839 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 11.5 p -88.66 147.8 24.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.172 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.492 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 56.1 t-105 -50.98 -28.07 9.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.9 -61.74 2.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.896 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.569 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 0.6 OUTLIER -54.54 -59.06 5.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.79 ' HG2' HG13 ' A' ' 675' ' ' VAL . 9.0 mt-10 -54.8 -41.05 70.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.916 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.492 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 8.1 tp -52.43 -68.59 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.569 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 4.4 p-80 -50.18 -31.64 14.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.861 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.401 ' HG3' ' NE2' ' A' ' 686' ' ' HIS . 45.6 mttt -68.35 -28.29 67.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 24.3 pt -119.15 15.48 6.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.14 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.498 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -83.85 -39.36 14.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.141 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.409 ' N ' ' CG1' ' A' ' 689' ' ' VAL . 15.4 p90 -68.24 -20.93 64.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.868 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.42 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.6 t70 -72.11 139.75 82.47 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.619 0.723 . . . . 0.0 110.873 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.77 -38.74 7.36 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.681 2.254 . . . . 0.0 112.367 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.551 ' HA ' HD12 ' A' ' 696' ' ' LEU . 59.4 mtm180 -53.84 -27.49 30.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.868 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.644 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 15.7 t80 -63.0 -23.41 67.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.93 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 17.4 mt -100.75 18.03 20.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.95 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 693' ' ' ARG . 74.2 mt -99.93 -41.53 7.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.909 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.751 HD12 ' HB2' ' A' ' 666' ' ' PHE . 29.2 mt -89.67 146.51 24.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.904 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 9.6 m-20 -47.09 161.47 0.3 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.627 0.727 . . . . 0.0 110.895 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -37.04 9.83 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.698 2.265 . . . . 0.0 112.34 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.02 -37.69 69.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.948 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.437 ' O ' ' C ' ' A' ' 702' ' ' ARG . 8.3 mt-10 -62.53 -55.3 28.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.879 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.644 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 50.1 mtm180 -34.5 -47.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.862 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 9.4 tppt? -71.2 -46.95 60.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.885 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -57.88 -59.98 4.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.901 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 96.1 t -52.62 -50.72 39.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.13 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.413 ' CZ ' ' OE1' ' A' ' 684' ' ' GLU . 20.9 t80 -49.11 -46.06 44.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.898 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -57.8 -54.78 43.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.881 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -52.84 -47.3 67.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.895 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.531 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 12.3 t80 -52.53 -51.03 61.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.951 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 41.1 t -58.02 -50.7 77.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.115 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -44.69 -56.42 4.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.908 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 39.7 p -60.35 -47.33 86.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.116 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.531 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.1 mmm180 -54.72 -21.73 11.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.054 179.949 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.551 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.5 Cg_endo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.83 0.263 . . . . 0.0 112.329 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 17.7 tp -58.78 -50.72 72.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 660' ' ' GLU . . . . . 0.47 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 6.0 tp10 -51.26 -34.43 32.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.551 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -70.62 -71.07 0.26 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.085 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -48.01 -49.79 29.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.864 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.682 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.9 mtt -55.91 -45.7 78.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.878 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 664' ' ' LYS . . . . . 0.47 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 8.5 mmmt -55.83 -42.26 75.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.4 -56.52 21.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.589 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 25.8 t80 -50.15 -49.71 51.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 33.8 tttt -62.16 -36.71 82.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -45.21 92.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.866 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.459 ' CG ' ' O ' ' A' ' 666' ' ' PHE . 3.0 ptt? -72.26 -38.67 68.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.9 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 25.3 mt -52.17 -47.49 65.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.954 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 22.0 tp -77.02 -50.36 13.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.94 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -53.19 -66.05 0.45 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.885 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -43.95 -31.36 0.87 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.874 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 96.25 45.9 2.7 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.502 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.408 HG13 ' CG ' ' A' ' 684' ' ' GLU . 74.7 t -72.4 89.57 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.857 0.36 . . . . 0.0 111.12 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 41.9 m -56.83 123.84 16.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.871 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 677' ' ' ALA . . . . . 0.86 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -56.62 -31.8 64.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.072 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -70.0 -22.88 63.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.871 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 24.5 t -67.1 173.62 3.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.845 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 25.2 p -104.42 158.21 16.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.165 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.461 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 44.9 t-105 -59.87 -33.19 71.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -60.97 -58.6 7.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.92 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.489 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 63.6 mttt -57.15 -59.06 5.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.843 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.408 ' CG ' HG13 ' A' ' 675' ' ' VAL . 13.2 mt-10 -55.5 -38.28 68.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.853 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.461 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 5.1 tp -53.5 -52.95 57.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.933 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.796 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.0 p-80 -65.52 -29.12 69.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 61.7 mttt -68.72 -33.28 73.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.949 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 688' ' ' ILE . . . . . 0.417 ' O ' ' CB ' ' A' ' 694' ' ' TYR . 7.5 pt -111.04 6.91 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.137 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.796 HG12 ' O ' ' A' ' 686' ' ' HIS . 8.0 p -66.03 -25.07 35.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.14 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.514 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 9.1 p90 -85.52 -47.15 10.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.514 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.4 t70 -34.28 142.05 0.23 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.626 0.727 . . . . 0.0 110.829 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.414 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.76 -39.32 6.66 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.715 2.276 . . . . 0.0 112.358 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.505 ' HA ' HD12 ' A' ' 696' ' ' LEU . 11.9 mtm-85 -67.19 -21.58 65.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.859 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.417 ' CB ' ' O ' ' A' ' 688' ' ' ILE . 18.8 t80 -63.96 -18.77 64.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 18.9 mt -109.9 23.53 14.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.948 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 693' ' ' ARG . 81.3 mt -105.12 -25.6 12.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.907 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.682 HD11 ' HA ' ' A' ' 663' ' ' MET . 27.9 mt -110.5 144.56 39.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.895 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -50.75 163.12 0.5 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.584 0.707 . . . . 0.0 110.893 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -31.7 20.02 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.706 2.271 . . . . 0.0 112.299 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -45.04 61.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.902 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 5.5 mm-40 -59.07 -54.53 46.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.907 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.589 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 38.1 mtp180 -34.28 -50.43 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -68.0 -45.67 73.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 704' ' ' GLN . . . . . 0.409 ' N ' ' O ' ' A' ' 701' ' ' GLU . 10.9 mm-40 -58.23 -60.32 3.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.913 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.4 t -54.71 -46.63 73.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.167 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.674 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 25.2 t80 -60.76 -41.4 95.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.907 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -54.92 -53.03 60.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.833 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -61.64 -39.04 89.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.929 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -63.99 -39.07 93.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.937 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.86 HG13 ' HB1' ' A' ' 677' ' ' ALA . 86.6 t -69.6 -53.92 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.114 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 12.8 mtpp -48.14 -48.47 34.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 45.3 p -66.85 -38.95 87.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 12.6 mmt-85 -62.19 -47.16 85.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.104 179.917 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.488 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.169 0 CA-C-O 120.856 0.273 . . . . 0.0 112.323 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 21.9 tp -59.99 -48.82 80.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -51.95 -32.76 34.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.855 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.488 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -74.0 -68.83 0.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.087 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.564 ' HG3' HD21 ' A' ' 697' ' ' LEU . 6.5 ptm180 -48.7 -48.36 40.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.891 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.766 ' HA ' HD11 ' A' ' 697' ' ' LEU . 9.2 mtt -59.05 -51.26 70.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -50.39 -39.37 46.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -63.24 -58.16 8.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.862 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.723 ' HB2' HD12 ' A' ' 697' ' ' LEU . 23.2 t80 -51.9 -43.95 63.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.897 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 34.0 tttp -69.7 -39.25 77.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.859 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -57.67 -43.32 84.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.871 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -71.99 -37.95 69.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.892 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.49 HD23 HG21 ' A' ' 675' ' ' VAL . 27.1 mt -53.86 -46.54 71.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 42.9 tp -75.46 -51.28 13.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.953 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -54.85 -63.62 1.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 12.7 mmp_? -45.78 -24.29 0.36 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.881 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 86.44 44.42 5.87 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.527 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.61 HG13 ' CD ' ' A' ' 684' ' ' GLU . 54.9 t -70.11 107.81 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.812 0.339 . . . . 0.0 111.162 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 39.1 m -63.36 149.87 44.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 677' ' ' ALA . . . . . 0.604 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -81.4 -52.94 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.131 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -57.79 -13.55 4.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.892 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -75.03 172.37 12.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.862 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 2.4 t -105.25 165.14 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.186 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.49 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 40.6 t-105 -62.73 -26.52 68.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -61.47 -62.11 2.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.405 ' O ' ' ND1' ' A' ' 686' ' ' HIS . 39.8 mttp -53.52 -58.94 5.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.914 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.61 ' CD ' HG13 ' A' ' 675' ' ' VAL . 46.7 mm-40 -55.48 -45.79 76.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.903 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.49 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.7 tp -45.59 -55.11 6.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.906 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.707 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.7 p-80 -64.13 -31.63 72.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.856 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.552 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 56.9 mttm -68.97 -22.84 64.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 8.7 pt -118.48 5.0 6.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.119 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.707 HG12 ' O ' ' A' ' 686' ' ' HIS . 7.9 p -69.9 -27.95 34.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.141 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.552 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 6.7 p90 -86.1 3.66 41.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 693' ' ' ARG . 9.4 t70 -94.96 139.8 22.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.605 0.717 . . . . 0.0 110.864 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.8 -34.02 15.3 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.675 2.25 . . . . 0.0 112.323 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.624 ' HA ' HD12 ' A' ' 696' ' ' LEU . 16.8 mtm-85 -67.49 -20.03 65.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.881 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 694' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -65.8 -16.96 64.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.969 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.1 mt -113.27 16.84 18.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.921 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.624 HD12 ' HA ' ' A' ' 693' ' ' ARG . 54.8 mt -96.03 -19.68 19.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.846 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.766 HD11 ' HA ' ' A' ' 663' ' ' MET . 30.8 mt -114.83 148.19 38.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.884 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 -50.1 161.91 0.54 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.6 0.715 . . . . 0.0 110.93 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -33.71 15.93 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.652 2.235 . . . . 0.0 112.288 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -72.01 -45.31 61.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.892 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 71.6 mm-40 -57.47 -53.47 57.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.585 ' HG2' ' CE2' ' A' ' 666' ' ' PHE . 10.7 mtp180 -34.42 -47.95 0.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -71.45 -45.35 62.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.892 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 704' ' ' GLN . . . . . 0.41 ' N ' ' O ' ' A' ' 701' ' ' GLU . 46.0 mm-40 -57.88 -59.26 5.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.906 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 91.6 t -55.62 -48.37 77.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.126 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.436 ' O ' HG23 ' A' ' 710' ' ' VAL . 26.4 t80 -56.34 -43.8 79.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.917 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -55.32 -53.24 58.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.863 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -58.08 -38.83 77.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.887 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -62.8 -42.78 99.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.917 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.604 HG13 ' HB1' ' A' ' 677' ' ' ALA . 89.2 t -67.36 -41.61 86.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.163 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -59.14 -39.06 81.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.864 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 21.2 p -74.09 -40.38 62.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.123 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -66.17 -26.37 67.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.868 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.094 179.909 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.402 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.9 Cg_endo . . . . . 0 N--CA 1.465 -0.169 0 CA-C-O 120.866 0.277 . . . . 0.0 112.36 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.5 HD12 ' HE ' ' A' ' 662' ' ' ARG . 14.5 tp -51.91 -54.84 24.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.899 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -53.71 -35.86 61.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.402 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -64.0 -70.94 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.125 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.5 ' HE ' HD12 ' A' ' 659' ' ' LEU . 14.7 ptt180 -50.8 -48.14 59.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.831 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.652 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.5 mtt -54.05 -42.73 69.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.873 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -58.85 -47.4 84.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.902 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -55.42 -52.12 64.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.747 ' HB2' HD12 ' A' ' 697' ' ' LEU . 25.1 t80 -54.46 -57.44 11.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.849 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.568 ' HA ' HD12 ' A' ' 670' ' ' LEU . 16.9 ttmt -54.63 -35.98 64.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.968 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -60.1 -52.85 63.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.531 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 2.7 ptt? -65.14 -36.58 84.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.901 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 667' ' ' LYS . 32.0 mt -54.23 -49.35 69.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.889 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 31.2 tp -74.01 -52.02 14.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 672' ' ' GLU . . . . . 0.435 ' O ' ' N ' ' A' ' 674' ' ' GLY . 19.0 mt-10 -55.09 -65.77 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 673' ' ' ARG . . . . . 0.415 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 16.1 mmp_? -39.49 -28.54 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.838 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 674' ' ' GLY . . . . . 0.435 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 93.99 42.85 3.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.511 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.454 HG21 HD23 ' A' ' 670' ' ' LEU . 53.0 t -71.43 94.6 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.874 0.368 . . . . 0.0 111.131 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 57.7 m -58.83 125.41 23.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.85 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -64.72 -32.2 73.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.088 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -83.81 34.72 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.919 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.3 t -125.9 -175.03 3.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.897 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 680' ' ' THR . . . . . 0.654 HG23 ' H ' ' A' ' 683' ' ' LYS . 12.9 t -106.17 158.76 16.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.13 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 50.1 t-105 -63.28 -38.07 89.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.887 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -54.28 -57.13 12.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.911 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.654 ' H ' HG23 ' A' ' 680' ' ' THR . 5.9 mtpm? -60.64 -59.62 5.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.905 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -52.55 -34.69 51.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 8.3 tp -59.11 -62.1 2.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.913 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.73 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.5 p-80 -50.58 -35.06 28.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.848 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.584 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 44.0 mttp -63.87 -40.03 95.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.911 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 12.0 pt -105.22 13.9 7.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.137 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.73 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.1 p -79.81 -24.32 12.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.161 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 12.2 p90 -75.42 -44.35 44.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.852 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.471 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 7.3 t70 -53.13 139.42 45.08 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.619 0.723 . . . . 0.0 110.832 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.412 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.2 Cg_endo -69.77 -34.77 13.87 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.715 2.277 . . . . 0.0 112.345 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.527 ' HA ' HD12 ' A' ' 696' ' ' LEU . 36.6 mtm180 -58.41 -17.45 20.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.896 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 694' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -66.61 -15.55 63.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.892 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 27.8 mt -103.65 -12.31 17.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.926 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 693' ' ' ARG . 64.7 mt -62.42 -52.76 62.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.747 HD12 ' HB2' ' A' ' 666' ' ' PHE . 30.6 mt -84.67 148.05 26.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -56.22 162.47 3.03 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.634 0.73 . . . . 0.0 110.91 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 699' ' ' PRO . . . . . 0.555 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.8 Cg_endo -69.7 -32.12 19.43 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.731 2.287 . . . . 0.0 112.352 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 44.1 mttt -72.29 -46.81 54.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.899 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -60.34 -51.76 68.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.92 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.555 HH21 ' N ' ' A' ' 699' ' ' PRO . 44.6 mtm180 -39.27 -45.38 1.39 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.9 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -70.91 -43.49 68.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.907 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -60.89 -59.54 5.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.94 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.8 t -54.65 -41.45 55.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.114 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.566 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 5.3 t80 -60.18 -48.33 82.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -54.02 -47.29 71.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.803 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -65.95 -41.26 91.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.892 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.527 ' CZ ' ' HG3' ' A' ' 713' ' ' ARG . 12.6 t80 -61.82 -47.9 83.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.892 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.566 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 92.9 t -59.46 -43.99 91.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.1 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -57.31 -49.2 76.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.915 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 13.8 p -64.63 -41.46 96.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.128 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.527 ' HG3' ' CZ ' ' A' ' 709' ' ' TYR . 3.4 mmp_? -64.63 -36.62 84.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.888 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.113 179.91 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.529 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.847 0.27 . . . . 0.0 112.347 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.444 HD12 ' HE ' ' A' ' 662' ' ' ARG . 10.4 tp -58.47 -48.62 80.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -55.36 -37.51 67.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.529 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -63.76 -66.1 0.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.124 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.802 ' HG3' HD21 ' A' ' 697' ' ' LEU . 11.2 ptt180 -51.5 -48.22 62.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.915 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.646 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.0 mtt -56.08 -47.58 77.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.906 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -52.59 -45.62 66.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.912 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -58.28 -62.35 1.9 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.926 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.49 ' CE2' HD11 ' A' ' 670' ' ' LEU . 22.9 t80 -45.1 -55.61 5.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.892 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -54.74 -48.11 72.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.882 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -47.84 -41.58 24.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.405 ' O ' ' C ' ' A' ' 670' ' ' LEU . 5.5 mtm -67.53 -63.96 0.95 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.883 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.49 HD11 ' CE2' ' A' ' 666' ' ' PHE . 44.6 mt -38.01 -34.85 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.916 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 15.9 tp -83.25 -56.03 4.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -54.71 -64.32 0.87 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.904 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 673' ' ' ARG . . . . . 0.405 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 2.5 mmp_? -44.38 -29.68 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.897 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 90.29 33.22 8.88 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.473 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.798 HG13 ' CD ' ' A' ' 684' ' ' GLU . 43.1 t -56.9 116.29 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 0.0 111.135 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 58.1 m -75.3 144.92 42.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.888 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 677' ' ' ALA . . . . . 0.425 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -82.68 -28.98 30.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.076 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -77.33 -2.06 33.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.853 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.2 m -90.57 -177.84 5.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.862 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 65.8 p -104.46 160.88 14.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.183 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.62 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 29.7 t-105 -64.75 -27.08 68.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.882 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -61.47 -58.83 6.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.868 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.44 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 17.0 mttm -55.73 -58.98 5.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.91 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.798 ' CD ' HG13 ' A' ' 675' ' ' VAL . 38.1 mm-40 -56.19 -44.85 79.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.869 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.62 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 6.4 tp -46.55 -62.26 1.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.929 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.493 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.5 p-80 -58.63 -30.62 67.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.868 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 43.5 mttm -69.34 -20.99 63.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 30.0 pt -122.68 8.31 5.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.189 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.493 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -77.7 -29.0 15.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.156 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.462 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 12.0 p90 -70.56 -44.43 67.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.915 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.462 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.6 t70 -53.22 139.76 45.19 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.573 0.702 . . . . 0.0 110.911 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.3 Cg_endo -69.67 -34.29 15.19 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.713 2.275 . . . . 0.0 112.369 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.588 ' HA ' HD12 ' A' ' 696' ' ' LEU . 16.5 mtm-85 -56.63 -24.39 47.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.874 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.45 ' CZ ' ' HD2' ' A' ' 702' ' ' ARG . 22.0 t80 -65.92 -17.88 64.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.888 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 15.8 mt -107.19 23.13 14.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 693' ' ' ARG . 78.5 mt -104.22 -29.5 10.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.89 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.802 HD21 ' HG3' ' A' ' 662' ' ' ARG . 26.7 mt -102.84 151.22 22.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.897 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 23.4 m-20 -50.74 161.85 0.62 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.635 0.731 . . . . 0.0 110.892 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 699' ' ' PRO . . . . . 0.403 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 54.1 Cg_endo -69.74 -37.1 9.69 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.725 2.283 . . . . 0.0 112.347 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -72.19 -39.28 68.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.916 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.451 ' O ' ' C ' ' A' ' 702' ' ' ARG . 35.7 mm-40 -59.88 -53.94 51.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.904 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.451 ' C ' ' O ' ' A' ' 701' ' ' GLU . 29.0 mtm105 -34.1 -48.03 0.3 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.914 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 16.5 tptt -72.35 -43.74 63.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.953 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 704' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' A' ' 701' ' ' GLU . 29.1 mt-30 -57.28 -56.92 15.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.908 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.72 -48.59 88.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.148 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.633 ' O ' HG23 ' A' ' 710' ' ' VAL . 52.7 t80 -57.2 -36.73 71.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.863 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -64.87 -51.5 61.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.864 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 708' ' ' GLN . . . . . 0.48 ' O ' HG23 ' A' ' 712' ' ' THR . 87.8 mm-40 -58.2 -36.34 72.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -67.18 -41.48 85.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.974 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 706' ' ' PHE . 96.7 t -69.42 -39.3 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.151 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 17.1 tttm -62.99 -40.58 98.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 712' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 708' ' ' GLN . 73.0 p -75.13 -38.59 61.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.13 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 5.8 mmm180 -60.23 -36.29 77.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.111 179.907 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.529 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.1 Cg_endo . . . . . 0 C--O 1.232 0.222 0 CA-C-O 120.872 0.28 . . . . 0.0 112.289 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.425 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 15.2 tp -49.93 -49.74 48.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.87 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -54.35 -41.16 68.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.918 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.529 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -62.31 -70.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.091 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.644 ' HG3' HD21 ' A' ' 697' ' ' LEU . 7.6 ptt180 -48.46 -46.76 38.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.878 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.3 mtt -57.5 -46.53 83.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.846 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 3.7 mmmm -53.43 -45.83 69.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.887 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -58.16 -60.91 3.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.897 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.639 ' HB2' HD12 ' A' ' 697' ' ' LEU . 18.0 t80 -48.72 -58.74 4.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.922 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.698 ' HA ' HD12 ' A' ' 670' ' ' LEU . 51.5 tttt -51.84 -37.45 52.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.919 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -58.71 -54.18 49.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.896 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.531 ' CE ' ' CE1' ' A' ' 666' ' ' PHE . 2.7 ptt? -65.42 -37.07 85.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.908 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.698 HD12 ' HA ' ' A' ' 667' ' ' LYS . 30.0 mt -52.0 -50.62 60.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 37.7 tp -74.74 -47.36 31.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -56.74 -66.08 0.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.906 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -42.64 -25.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.853 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 85.98 44.34 6.04 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.479 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.558 HG13 ' CG ' ' A' ' 684' ' ' GLU . 25.8 t -68.37 109.62 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.784 0.326 . . . . 0.0 111.1 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 24.5 m -67.51 136.45 54.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.831 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 677' ' ' ALA . . . . . 0.673 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -69.58 -55.74 9.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.125 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -54.27 -30.81 51.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.852 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.9 m -55.83 167.14 0.61 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.863 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 44.8 p -93.88 153.45 18.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.154 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 33.9 t-105 -57.47 -26.1 60.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.933 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.25 -60.24 3.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.881 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -54.03 -59.07 5.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.87 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.558 ' CG ' HG13 ' A' ' 675' ' ' VAL . 59.6 mm-40 -54.39 -43.98 71.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 7.0 tp -48.23 -57.63 5.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.605 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.5 p-80 -59.29 -33.74 71.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.839 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.475 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 24.5 mttp -65.29 -26.08 67.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 16.4 pt -117.29 7.87 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.153 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.605 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -76.88 -35.91 24.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.11 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.451 ' CE1' ' O ' ' A' ' 687' ' ' LYS . 47.9 p90 -83.41 13.84 4.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 693' ' ' ARG . 2.9 t70 -102.46 143.61 26.95 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.614 0.721 . . . . 0.0 110.843 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.409 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.74 -46.81 1.1 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.688 2.259 . . . . 0.0 112.332 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.514 ' HA ' HD12 ' A' ' 696' ' ' LEU . 54.8 mtm180 -53.96 -26.06 23.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.607 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 0.7 OUTLIER -66.48 -27.92 68.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.938 -179.858 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.9 mt -89.0 2.85 53.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.964 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 693' ' ' ARG . 94.8 mt -86.98 -42.22 13.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.912 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.644 HD21 ' HG3' ' A' ' 662' ' ' ARG . 29.7 mt -91.17 144.46 25.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.891 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -51.41 161.85 0.75 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.58 0.705 . . . . 0.0 110.923 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -35.1 13.31 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.682 2.255 . . . . 0.0 112.34 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -72.09 -45.95 58.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -59.38 -45.55 91.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.839 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.607 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 42.0 mtt180 -43.45 -45.14 6.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.822 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.11 -44.68 62.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.875 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -57.6 -60.0 4.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.93 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 72.2 t -55.21 -47.12 77.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.159 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.577 ' O ' HG23 ' A' ' 710' ' ' VAL . 37.2 t80 -56.59 -41.25 76.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.897 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -59.12 -49.54 77.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.848 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -62.04 -42.63 99.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.93 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.586 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 7.0 t80 -58.75 -37.67 76.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.958 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.673 HG13 ' HB1' ' A' ' 677' ' ' ALA . 96.8 t -69.88 -45.89 75.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.162 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 26.9 tttm -51.95 -51.94 53.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.903 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 3.9 p -68.81 -31.1 69.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.175 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.586 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 3.2 mmm180 -65.96 -33.76 76.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.924 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.138 179.879 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.539 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.3 Cg_endo . . . . . 0 C--O 1.232 0.19 0 CA-C-O 120.856 0.273 . . . . 0.0 112.352 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.429 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 13.2 tp -49.25 -44.51 43.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -58.95 -42.26 89.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.539 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -61.0 -65.06 0.75 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.065 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.475 ' HG3' HD21 ' A' ' 697' ' ' LEU . 10.3 ptt180 -53.18 -54.33 37.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.904 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.521 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.7 mtt -51.47 -46.06 62.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.846 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.4 -43.4 71.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -59.55 -58.76 7.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.894 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.685 ' HB2' HD12 ' A' ' 697' ' ' LEU . 26.9 t80 -50.64 -51.31 50.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.89 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.434 ' HA ' HD12 ' A' ' 670' ' ' LEU . 27.4 tttt -60.89 -35.35 76.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.927 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -61.8 -56.61 17.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -59.87 -36.24 76.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.887 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.564 HD11 ' CE2' ' A' ' 666' ' ' PHE . 34.6 mt -56.95 -48.59 77.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.906 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.77 -45.23 62.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 672' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' A' ' 674' ' ' GLY . 23.2 mt-10 -61.67 -65.81 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -41.5 -24.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 674' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 86.71 46.86 5.02 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.452 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.44 HG13 ' CG ' ' A' ' 684' ' ' GLU . 24.4 t -72.22 106.4 2.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.829 0.347 . . . . 0.0 111.13 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 9.3 t -65.59 140.02 58.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.866 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 677' ' ' ALA . . . . . 0.4 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -78.75 -44.07 24.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.072 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -63.78 -20.89 66.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.4 m -69.04 -175.52 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.868 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 680' ' ' THR . . . . . 0.404 HG23 ' H ' ' A' ' 683' ' ' LYS . 12.5 t -106.61 167.24 9.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.136 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.498 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 31.4 t-105 -69.13 -26.8 65.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.866 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -61.2 -63.01 1.43 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.875 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.404 ' H ' HG23 ' A' ' 680' ' ' THR . 5.9 mtpm? -52.67 -59.03 4.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.44 ' CG ' HG13 ' A' ' 675' ' ' VAL . 49.1 mm-40 -55.51 -44.54 76.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.498 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.3 tp -47.79 -55.99 8.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.914 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.55 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.8 p-80 -61.9 -31.82 72.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.469 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 82.5 mttt -66.66 -24.91 66.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.918 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 20.9 pt -120.68 9.01 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.103 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.55 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.0 p -75.22 -26.69 18.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.175 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -84.65 -39.05 19.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.877 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.423 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 8.6 t70 -43.59 139.78 2.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.655 0.741 . . . . 0.0 110.867 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.82 -36.28 10.94 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.638 2.225 . . . . 0.0 112.357 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.644 ' HA ' HD12 ' A' ' 696' ' ' LEU . 57.0 mtm180 -65.16 -20.07 66.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.856 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.59 ' CE2' ' HD2' ' A' ' 702' ' ' ARG . 0.6 OUTLIER -66.03 -21.29 66.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.926 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 52.1 mt -93.89 -13.76 26.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.905 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.644 HD12 ' HA ' ' A' ' 693' ' ' ARG . 63.7 mt -67.47 -52.05 43.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.685 HD12 ' HB2' ' A' ' 666' ' ' PHE . 33.3 mt -79.72 147.23 32.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.91 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -51.51 162.54 0.69 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.627 0.727 . . . . 0.0 110.89 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 699' ' ' PRO . . . . . 0.402 ' HA ' ' CZ ' ' A' ' 702' ' ' ARG . 53.5 Cg_endo -69.75 -36.61 10.51 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.683 2.255 . . . . 0.0 112.335 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -72.19 -41.68 66.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 15.7 mt-10 -58.68 -51.22 70.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.59 ' HD2' ' CE2' ' A' ' 694' ' ' TYR . 24.7 mtm105 -34.23 -50.88 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.849 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -70.56 -46.2 63.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -55.47 -61.16 2.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.926 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 65.9 t -54.06 -45.19 65.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.086 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.68 -52.42 63.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.866 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -51.13 -47.19 62.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -63.4 -39.82 95.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.57 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 20.3 t80 -63.69 -49.63 72.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.921 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.4 HG13 ' HB1' ' A' ' 677' ' ' ALA . 82.4 t -55.93 -42.49 71.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.128 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -60.3 -46.17 90.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.899 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 15.8 p -65.8 -37.33 86.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.119 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.57 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.3 mmm180 -67.04 -28.73 68.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.104 179.964 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.556 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.9 Cg_endo . . . . . 0 C--O 1.232 0.199 0 CA-C-O 120.811 0.255 . . . . 0.0 112.34 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 31.4 tp -54.69 -51.11 66.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.933 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 660' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 12.0 mm-40 -55.64 -30.5 61.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.92 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.556 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -71.84 -70.99 0.3 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.126 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.75 ' CZ ' HD23 ' A' ' 697' ' ' LEU . 0.1 OUTLIER -48.35 -52.69 20.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.897 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.606 ' HA ' HD11 ' A' ' 697' ' ' LEU . 6.0 mtt -54.84 -48.48 72.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 664' ' ' LYS . . . . . 0.467 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 1.7 mmmm -53.16 -37.45 61.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.916 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -64.01 -56.42 15.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.906 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.65 ' HB2' HD12 ' A' ' 697' ' ' LEU . 29.4 t80 -52.31 -47.61 65.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.504 ' HA ' HD12 ' A' ' 670' ' ' LEU . 41.3 tttt -67.26 -34.26 77.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.92 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -62.99 -44.76 95.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.877 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.431 ' O ' ' CG ' ' A' ' 673' ' ' ARG . 2.8 ptt? -70.35 -32.36 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 667' ' ' LYS . 40.8 mt -60.85 -49.82 75.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.892 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.5 tp -70.89 -55.91 7.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.942 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 672' ' ' GLU . . . . . 0.405 ' C ' ' N ' ' A' ' 674' ' ' GLY . 15.9 mt-10 -49.31 -63.58 1.06 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 673' ' ' ARG . . . . . 0.431 ' CG ' ' O ' ' A' ' 669' ' ' MET . 4.6 mmp_? -45.67 -21.31 0.11 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.843 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 674' ' ' GLY . . . . . 0.405 ' N ' ' C ' ' A' ' 672' ' ' GLU . . . 85.7 46.02 5.57 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.486 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.881 HG13 ' CD ' ' A' ' 684' ' ' GLU . 70.9 t -78.32 103.56 5.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 111.142 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 16.4 m -67.7 158.51 32.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.871 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 677' ' ' ALA . . . . . 0.445 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -88.57 -36.81 16.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.072 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -66.55 -10.08 41.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.919 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.1 m -82.7 175.49 10.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.822 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 59.4 p -102.44 178.33 4.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.172 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.462 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 50.6 t-105 -76.08 -25.22 55.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.933 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -67.15 -56.76 8.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.883 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.498 ' O ' ' CD2' ' A' ' 686' ' ' HIS . 59.6 mttm -53.94 -59.03 5.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.875 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.881 ' CD ' HG13 ' A' ' 675' ' ' VAL . 64.0 mm-40 -57.77 -45.8 85.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.462 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 7.9 tp -45.27 -53.38 8.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.921 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.645 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.7 p80 -68.41 -28.65 67.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.897 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.562 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 37.9 mttm -68.96 -21.12 64.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 26.1 pt -121.96 -0.38 7.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.115 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 686' ' ' HIS . 8.7 p -62.82 -25.32 38.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.13 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.562 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 18.6 p90 -93.59 11.66 28.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.835 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.429 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.5 t70 -99.3 139.85 21.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.596 0.712 . . . . 0.0 110.877 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.78 -31.78 19.78 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.688 2.259 . . . . 0.0 112.302 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 22.4 mtm-85 -67.21 -21.49 65.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.841 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.473 ' CD1' ' O ' ' A' ' 694' ' ' TYR . 10.6 t80 -68.55 -5.53 20.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.1 mt -120.91 14.8 11.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.944 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 55.5 mt -95.51 -26.18 15.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.939 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.75 HD23 ' CZ ' ' A' ' 662' ' ' ARG . 29.8 mt -112.12 155.56 23.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 698' ' ' ASN . . . . . 0.422 ' HB3' ' HD2' ' A' ' 699' ' ' PRO . 0.2 OUTLIER -54.47 158.52 4.02 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.603 0.716 . . . . 0.0 110.884 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 699' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 698' ' ' ASN . 53.2 Cg_endo -69.82 -33.73 15.77 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.626 2.217 . . . . 0.0 112.345 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -72.69 -46.01 55.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.945 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' A' ' 704' ' ' GLN . 0.4 OUTLIER -62.35 -54.52 39.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.877 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.528 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 57.0 mtm180 -34.21 -48.29 0.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.902 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.57 -41.34 69.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.901 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 704' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 701' ' ' GLU . 21.5 mm-40 -60.39 -56.63 19.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 33.2 t -57.31 -43.25 81.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.116 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.495 ' O ' HG23 ' A' ' 710' ' ' VAL . 21.8 t80 -62.17 -37.93 87.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.891 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -60.86 -49.86 75.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.863 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -61.44 -35.34 77.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.539 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 0.8 OUTLIER -65.65 -35.98 82.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.954 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 706' ' ' PHE . 93.5 t -70.95 -51.3 36.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.135 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 12.9 ttmt -56.8 -35.81 69.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.918 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 15.6 p -75.1 -39.78 60.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.184 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.539 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 2.4 mmp_? -64.32 -35.66 81.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.85 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.112 179.918 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.232 0.187 0 CA-C-O 120.815 0.256 . . . . 0.0 112.338 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.43 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 18.6 tp -48.05 -49.05 32.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -55.53 -41.13 72.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -61.47 -67.64 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.727 ' HG3' HD21 ' A' ' 697' ' ' LEU . 7.9 ptt180 -51.14 -46.4 61.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.869 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.58 ' HA ' HD11 ' A' ' 697' ' ' LEU . 6.7 mtt -58.83 -49.47 77.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.895 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 16.3 mtmt -49.62 -46.24 49.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 665' ' ' GLN . . . . . 0.471 ' OE1' ' CD1' ' A' ' 696' ' ' LEU . 86.4 mt-30 -59.33 -64.1 1.06 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.885 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.736 ' HB2' HD12 ' A' ' 697' ' ' LEU . 27.6 t80 -41.52 -56.95 2.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.88 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 35.1 tttp -54.94 -47.41 74.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -50.59 -33.17 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.854 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.423 ' O ' ' C ' ' A' ' 670' ' ' LEU . 5.4 mtm -74.58 -65.79 0.82 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' A' ' 669' ' ' MET . 83.6 mt -35.3 -40.91 0.15 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.89 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.9 tp -76.67 -58.15 3.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.934 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 672' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 674' ' ' GLY . 8.3 mm-40 -57.78 -64.3 0.95 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 673' ' ' ARG . . . . . 0.434 ' C ' ' O ' ' A' ' 672' ' ' GLU . 4.2 mmp_? -35.02 -34.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.873 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 674' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 98.03 42.27 3.09 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.419 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.631 HG13 ' HG3' ' A' ' 684' ' ' GLU . 94.9 t -75.56 136.94 23.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.844 0.354 . . . . 0.0 111.156 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 15.9 m -103.7 121.89 43.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.841 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 677' ' ' ALA . . . . . 0.526 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -45.98 -57.88 4.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.121 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -46.46 -30.24 2.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.902 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.87 160.72 11.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.854 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 680' ' ' THR . . . . . 0.517 HG23 ' H ' ' A' ' 683' ' ' LYS . 14.4 t -82.33 -177.74 6.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.146 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.558 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 19.3 t-105 -84.3 -34.52 23.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.938 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -64.32 -59.86 3.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.517 ' H ' HG23 ' A' ' 680' ' ' THR . 12.4 mtpt -46.25 -58.94 3.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.915 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.631 ' HG3' HG13 ' A' ' 675' ' ' VAL . 31.9 mm-40 -62.64 -47.58 83.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.852 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.558 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 7.3 tp -43.16 -48.54 6.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.92 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.693 ' O ' HG12 ' A' ' 689' ' ' VAL . 0.9 OUTLIER -70.42 -38.43 74.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.85 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.517 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 44.3 mttp -60.56 -19.56 57.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.835 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 19.5 pt -115.39 -16.78 8.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.147 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -55.26 -32.41 28.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.143 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -62.74 -36.41 82.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.861 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.425 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 8.5 t70 -64.0 139.74 97.73 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.609 0.719 . . . . 0.0 110.848 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.8 -36.92 9.82 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.708 2.272 . . . . 0.0 112.315 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.47 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 22.3 mtm-85 -56.39 -19.72 16.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.852 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.614 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 27.5 t80 -66.76 -18.5 65.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.894 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 20.1 mt -96.3 -3.85 43.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.471 ' CD1' ' OE1' ' A' ' 665' ' ' GLN . 83.0 mt -77.09 -43.72 33.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.911 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.736 HD12 ' HB2' ' A' ' 666' ' ' PHE . 31.9 mt -89.88 152.24 21.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.904 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 24.2 m-20 -61.84 162.1 18.56 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.663 0.744 . . . . 0.0 110.849 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 699' ' ' PRO . . . . . 0.422 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.4 Cg_endo -69.7 -34.06 15.57 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.694 2.262 . . . . 0.0 112.364 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 29.3 mttm -72.13 -47.07 53.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 24.4 mt-10 -60.75 -56.53 20.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.903 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.614 ' NH1' ' CE2' ' A' ' 694' ' ' TYR . 46.0 mtm180 -34.59 -45.41 0.24 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.849 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.34 -45.76 62.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 704' ' ' GLN . . . . . 0.435 ' N ' ' O ' ' A' ' 701' ' ' GLU . 11.2 mm100 -57.12 -50.35 73.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.914 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.64 -39.24 83.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.11 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.831 ' O ' HG23 ' A' ' 710' ' ' VAL . 24.4 t80 -65.22 -36.84 85.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.859 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -64.68 -52.39 57.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.88 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 708' ' ' GLN . . . . . 0.466 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 5.5 pt20 -60.67 -36.65 79.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.913 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.488 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 11.7 t80 -66.76 -39.5 87.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.924 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 706' ' ' PHE . 99.6 t -64.55 -45.63 95.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.196 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 711' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 711' ' ' LYS . 0.9 OUTLIER -59.38 -52.22 66.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.9 179.867 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 18.4 p -60.16 -37.79 81.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.157 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.488 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 3.4 mmp_? -65.11 -38.28 90.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.902 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.142 179.882 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.821 0.259 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 25.3 tp -51.14 -48.57 61.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.938 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 660' ' ' GLU . . . . . 0.485 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 14.1 pt-20 -56.03 -36.19 67.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.87 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.41 -71.07 0.22 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.148 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.454 ' HE ' HD23 ' A' ' 697' ' ' LEU . 3.3 ptm180 -46.53 -56.98 5.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.464 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.9 mtt -50.69 -49.8 56.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.902 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 664' ' ' LYS . . . . . 0.485 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 2.5 mmmm -51.74 -41.09 61.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.91 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -60.8 -56.46 20.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.883 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.635 ' HB2' HD12 ' A' ' 697' ' ' LEU . 24.8 t80 -51.73 -55.55 19.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.83 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -54.89 -35.86 64.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.928 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -60.14 -47.58 85.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.856 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.526 ' CE ' ' CE1' ' A' ' 666' ' ' PHE . 2.9 ptt? -72.75 -36.4 67.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.894 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.533 HD11 ' CE2' ' A' ' 666' ' ' PHE . 33.1 mt -52.42 -51.19 60.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.965 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 23.3 tp -76.96 -53.62 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.939 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -49.64 -61.44 2.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.874 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 15.6 mmp_? -49.42 -19.57 0.56 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 82.09 44.34 7.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.45 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.44 HG13 ' CG ' ' A' ' 684' ' ' GLU . 71.7 t -70.13 103.54 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.839 0.352 . . . . 0.0 111.136 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 19.4 t -63.0 145.54 55.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.824 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 677' ' ' ALA . . . . . 0.487 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -81.58 -36.85 28.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.1 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -72.75 -9.11 58.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.865 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.1 m -80.94 168.13 19.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.885 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 15.2 t -95.81 173.62 7.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.182 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.467 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 57.0 t-105 -70.64 -30.82 67.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.876 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -59.79 -59.16 5.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.574 ' HA ' ' CD2' ' A' ' 686' ' ' HIS . 38.5 mttm -56.78 -59.01 5.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.44 ' CG ' HG13 ' A' ' 675' ' ' VAL . 56.5 mm-40 -55.51 -39.27 70.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.872 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.467 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 8.0 tp -53.37 -59.6 4.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.868 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.713 ' O ' HG12 ' A' ' 689' ' ' VAL . 2.0 p80 -60.02 -27.6 67.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.879 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.556 ' HG3' ' CE1' ' A' ' 686' ' ' HIS . 47.6 mttm -69.25 -34.18 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.877 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 7.5 pt -111.26 9.66 8.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.125 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 686' ' ' HIS . 9.8 p -70.25 -32.71 51.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.117 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 5.2 p90 -77.1 -38.49 52.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.864 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.447 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 9.1 t70 -50.94 139.76 21.96 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.559 0.695 . . . . 0.0 110.887 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.2 Cg_endo -69.76 -37.82 8.64 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.693 2.262 . . . . 0.0 112.329 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.476 ' HA ' HD12 ' A' ' 696' ' ' LEU . 14.4 mtm-85 -58.87 -20.98 56.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.88 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.438 ' OH ' ' CD1' ' A' ' 685' ' ' LEU . 61.8 t80 -69.2 -7.76 39.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.912 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 33.2 mt -119.07 20.48 12.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.476 HD12 ' HA ' ' A' ' 693' ' ' ARG . 96.7 mt -104.57 -34.98 8.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.934 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.635 HD12 ' HB2' ' A' ' 666' ' ' PHE . 29.1 mt -101.55 144.34 30.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.92 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -48.7 161.88 0.39 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.659 0.742 . . . . 0.0 110.842 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 699' ' ' PRO . . . . . 0.414 ' HA ' ' NE ' ' A' ' 702' ' ' ARG . 54.3 Cg_endo -69.7 -33.88 15.89 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.693 2.262 . . . . 0.0 112.358 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 3.9 mptt -72.15 -44.96 62.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.836 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.508 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -61.28 -50.74 71.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.895 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.414 ' NE ' ' HA ' ' A' ' 699' ' ' PRO . 53.8 mtm180 -39.97 -45.28 1.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 703' ' ' LYS . . . . . 0.403 ' HD2' ' C ' ' A' ' 703' ' ' LYS . 2.0 tmmm? -71.68 -43.89 65.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.857 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -58.62 -58.17 9.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.0 t -57.56 -40.66 76.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.107 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.893 ' O ' HG23 ' A' ' 710' ' ' VAL . 18.5 t80 -66.78 -30.66 70.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.922 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 707' ' ' ASP . . . . . 0.428 ' C ' ' OD1' ' A' ' 707' ' ' ASP . 0.8 OUTLIER -66.44 -55.28 16.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.864 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 708' ' ' GLN . . . . . 0.401 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 7.0 pt20 -57.9 -41.72 83.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.936 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.546 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 0.8 OUTLIER -60.2 -41.01 92.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.953 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 706' ' ' PHE . 92.8 t -63.56 -50.42 78.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.085 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -51.14 -51.62 51.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.907 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 2.3 p -60.18 -40.47 90.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.122 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.546 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 2.6 mmp_? -66.16 -26.96 67.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.842 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.094 179.954 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.0 Cg_endo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.83 0.263 . . . . 0.0 112.333 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 23.7 tp -56.19 -48.71 75.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 660' ' ' GLU . . . . . 0.462 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 29.3 mt-10 -56.05 -32.64 64.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.848 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.433 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -69.97 -69.98 0.32 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.135 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.616 ' HG3' HD21 ' A' ' 697' ' ' LEU . 5.6 ptm180 -45.56 -48.09 14.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.855 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.701 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.5 mtt -56.39 -54.02 50.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 664' ' ' LYS . . . . . 0.462 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 3.3 mmpt? -48.37 -46.49 36.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -55.62 -63.37 1.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.734 ' HB2' HD12 ' A' ' 697' ' ' LEU . 22.8 t80 -45.38 -52.43 9.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.922 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -58.35 -44.22 88.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.861 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -51.47 -39.75 58.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.829 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 16.3 mtm -68.73 -58.6 3.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 52.6 mt -43.11 -38.37 2.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.911 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 15.4 tp -80.41 -58.88 2.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -52.85 -64.36 0.84 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.904 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -46.3 -25.76 0.69 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.821 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 85.78 31.07 22.04 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.468 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.572 HG13 ' CD ' ' A' ' 684' ' ' GLU . 24.4 t -53.84 108.74 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.857 0.36 . . . . 0.0 111.142 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 8.3 t -64.55 149.71 48.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.87 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 677' ' ' ALA . . . . . 0.486 ' HA ' HG13 ' A' ' 710' ' ' VAL . . . -82.56 -39.82 21.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.118 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -66.53 -24.69 66.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.858 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.8 m -63.66 171.0 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.884 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 680' ' ' THR . . . . . 0.625 HG22 ' HE3' ' A' ' 683' ' ' LYS . 10.8 t -100.25 166.07 11.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 52.6 t-105 -63.53 -33.32 75.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.897 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -58.79 -56.11 26.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.88 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.625 ' HE3' HG22 ' A' ' 680' ' ' THR . 26.6 mtmt -57.7 -59.08 5.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.881 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.572 ' CD ' HG13 ' A' ' 675' ' ' VAL . 56.1 mm-40 -55.99 -37.67 69.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.894 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 18.0 tp -53.75 -58.79 5.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.667 ' O ' HG12 ' A' ' 689' ' ' VAL . 2.5 p-80 -59.4 -32.03 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.822 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.549 ' O ' ' CE2' ' A' ' 690' ' ' PHE . 40.9 mttm -66.17 -29.03 69.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.868 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 20.1 pt -114.75 8.16 7.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.141 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.667 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.0 p -75.37 -34.53 30.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.127 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.549 ' CE2' ' O ' ' A' ' 687' ' ' LYS . 51.3 p90 -81.85 12.67 3.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.896 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.426 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 11.2 t70 -101.23 139.9 20.83 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.581 0.705 . . . . 0.0 110.849 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.72 -40.07 5.82 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.676 2.251 . . . . 0.0 112.347 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.434 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 16.1 mtm-85 -61.43 -30.96 70.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.836 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.455 ' CE1' ' HD3' ' A' ' 702' ' ' ARG . 41.2 t80 -59.91 -12.93 8.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.911 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.413 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 28.4 mt -108.58 19.76 19.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.911 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.434 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 97.6 mt -101.73 -48.59 4.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.876 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.734 HD12 ' HB2' ' A' ' 666' ' ' PHE . 29.0 mt -82.71 146.84 28.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.902 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -49.95 161.65 0.54 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.642 0.734 . . . . 0.0 110.92 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -34.31 14.96 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.723 2.282 . . . . 0.0 112.356 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -72.09 -45.23 61.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.897 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 702' ' ' ARG . 67.7 mm-40 -58.6 -50.77 72.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.9 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.455 ' HD3' ' CE1' ' A' ' 694' ' ' TYR . 68.7 mtt180 -35.82 -49.24 0.6 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.892 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 10.8 tptp -71.76 -44.83 63.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.854 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -57.46 -62.25 1.91 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.929 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 66.7 t -53.77 -48.43 61.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.17 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.672 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 23.8 t80 -61.07 -37.46 82.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -57.27 -50.86 71.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.919 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -61.38 -40.5 94.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.566 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 4.2 t80 -63.52 -40.93 98.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.908 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.672 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 85.4 t -67.03 -53.61 32.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.153 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 13.6 mtpp -48.69 -53.55 18.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.852 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 1.1 p -61.27 -41.44 96.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.119 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.566 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 12.7 mmm180 -64.23 -25.79 68.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.869 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.09 179.912 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.52 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.197 0 CA-C-O 120.786 0.244 . . . . 0.0 112.359 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 41.2 tp -49.26 -49.21 44.48 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.897 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -51.83 -39.69 59.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.878 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.52 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -66.59 -70.29 0.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.116 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -44.05 -43.34 6.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.875 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.623 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.6 mtt -65.29 -40.32 93.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.86 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 17.3 mmmt -59.55 -41.41 90.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -65.16 -63.6 1.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.936 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.738 ' HB2' HD12 ' A' ' 697' ' ' LEU . 25.8 t80 -39.94 -57.2 1.66 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.861 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -54.64 -48.35 72.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.924 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -49.98 -35.39 24.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.848 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.427 ' O ' ' N ' ' A' ' 672' ' ' GLU . 4.7 mtm -71.84 -65.32 0.78 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.454 HD11 ' CE2' ' A' ' 666' ' ' PHE . 49.7 mt -36.83 -38.94 0.19 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.912 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 12.6 tp -75.51 -44.68 42.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 672' ' ' GLU . . . . . 0.427 ' N ' ' O ' ' A' ' 669' ' ' MET . 11.5 mm-40 -72.87 -64.55 0.94 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.892 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 673' ' ' ARG . . . . . 0.429 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 12.5 mmp_? -39.16 -35.68 0.25 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.847 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 98.66 28.67 7.78 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.46 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.569 HG13 ' CG ' ' A' ' 684' ' ' GLU . 38.0 t -59.43 91.78 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.847 0.356 . . . . 0.0 111.135 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 73.7 m -49.11 151.16 1.4 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.821 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -84.69 -48.11 9.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.127 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -56.36 -31.26 63.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.865 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -60.28 -178.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.889 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 10.9 t -104.45 -177.3 3.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.146 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.492 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 45.9 t-105 -83.05 -29.5 28.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.891 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -60.88 -60.79 3.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.881 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -54.15 -58.99 5.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.948 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.569 ' CG ' HG13 ' A' ' 675' ' ' VAL . 23.9 mm-40 -56.44 -42.51 78.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.895 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.492 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 7.7 tp -48.49 -54.92 12.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.985 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.631 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.8 p-80 -63.67 -32.69 74.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 40.2 mttm -66.41 -23.22 66.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 22.4 pt -120.08 5.76 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.147 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.631 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.3 p -73.0 -25.24 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.117 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.577 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 13.1 p90 -76.25 -52.37 10.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.863 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.577 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.0 t70 -37.14 139.84 0.48 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.577 0.703 . . . . 0.0 110.862 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.5 Cg_endo -69.8 -36.49 10.61 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.631 2.22 . . . . 0.0 112.326 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.47 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 69.3 mtm180 -63.86 -19.44 65.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.53 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 27.7 t80 -66.07 -15.14 62.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.947 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 14.1 mt -101.47 3.71 40.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.897 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.47 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 80.3 mt -83.71 -49.58 8.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.885 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.738 HD12 ' HB2' ' A' ' 666' ' ' PHE . 30.7 mt -83.81 143.91 29.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -52.11 162.33 0.85 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.651 0.739 . . . . 0.0 110.873 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 699' ' ' PRO . . . . . 0.41 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.7 Cg_endo -69.79 -35.42 12.59 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.674 2.249 . . . . 0.0 112.349 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 35.5 mttm -72.16 -46.3 56.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.877 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -59.7 -51.2 70.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.541 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 47.3 mtm180 -40.09 -46.92 2.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.908 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -68.15 -45.89 72.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.884 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -58.04 -58.47 8.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 97.6 t -55.06 -37.47 42.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.121 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.682 ' O ' HG23 ' A' ' 710' ' ' VAL . 16.3 t80 -69.0 -32.13 71.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.844 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -68.58 -47.21 67.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.829 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 708' ' ' GLN . . . . . 0.403 ' HG2' ' N ' ' A' ' 709' ' ' TYR . 4.0 pt20 -68.17 -36.89 80.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.945 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.481 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 3.7 t80 -66.26 -41.02 90.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.931 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.682 HG23 ' O ' ' A' ' 706' ' ' PHE . 57.7 t -65.55 -45.51 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.138 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 6.8 ttmm -57.97 -51.24 70.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.903 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.7 p -61.39 -38.16 86.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.133 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.481 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 9.4 mmp_? -65.26 -33.65 76.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.888 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.15 179.864 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.514 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.163 0 CA-C-O 120.818 0.257 . . . . 0.0 112.317 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.412 HD12 ' HE ' ' A' ' 662' ' ' ARG . 13.8 tp -57.88 -53.43 58.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -51.84 -35.52 44.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.904 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.514 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -64.86 -68.01 0.39 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.114 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.785 ' HG3' HD21 ' A' ' 697' ' ' LEU . 14.3 ptt180 -52.12 -41.72 62.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.885 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.612 ' HA ' HD11 ' A' ' 697' ' ' LEU . 6.7 mtt -61.76 -43.27 99.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 664' ' ' LYS . . . . . 0.432 ' HA ' ' CE ' ' A' ' 664' ' ' LYS . 0.4 OUTLIER -58.44 -41.66 85.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.928 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 665' ' ' GLN . . . . . 0.568 ' OE1' HD13 ' A' ' 696' ' ' LEU . 81.5 mt-30 -61.23 -54.0 49.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.962 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.692 ' HB2' HD12 ' A' ' 697' ' ' LEU . 23.2 t80 -56.07 -45.19 79.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 6.0 ttpt -66.84 -36.47 82.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.919 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -60.33 -46.91 88.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.849 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.407 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 2.8 ptt? -69.2 -36.84 77.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.539 HD23 HG21 ' A' ' 675' ' ' VAL . 36.2 mt -56.4 -44.28 80.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.926 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 54.0 tp -76.34 -54.71 6.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.86 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.08 -61.9 1.95 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -48.07 -19.51 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.904 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 81.83 41.17 9.88 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.473 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.658 HG13 ' CG ' ' A' ' 684' ' ' GLU . 77.1 t -65.1 100.81 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.854 0.359 . . . . 0.0 111.151 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 58.2 m -52.22 148.07 6.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.873 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 677' ' ' ALA . . . . . 0.54 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -84.04 -39.34 19.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.126 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -82.69 43.91 0.87 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.8 m -130.86 -175.8 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.844 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 680' ' ' THR . . . . . 0.415 HG23 ' H ' ' A' ' 683' ' ' LYS . 3.3 t -109.72 162.74 14.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.12 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.495 ' CH2' ' HB3' ' A' ' 702' ' ' ARG . 35.1 t-105 -65.37 -27.31 68.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.941 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -59.44 -60.17 4.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.924 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.415 ' H ' HG23 ' A' ' 680' ' ' THR . 22.6 mtpt -55.23 -59.0 5.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.658 ' CG ' HG13 ' A' ' 675' ' ' VAL . 49.9 mm-40 -54.8 -41.9 71.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.868 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.1 tp -50.66 -55.22 17.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.841 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.1 p-80 -60.05 -35.03 74.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.844 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.544 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 22.2 mttp -67.53 -23.04 65.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.899 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 6.9 pt -116.73 6.47 7.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.072 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.841 HG12 ' O ' ' A' ' 686' ' ' HIS . 9.0 p -70.93 -24.69 24.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.111 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.527 ' C ' ' CD1' ' A' ' 690' ' ' PHE . 2.4 p90 -87.98 -13.25 42.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.885 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.431 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.6 t70 -77.4 139.87 64.33 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.643 0.735 . . . . 0.0 110.824 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.0 Cg_endo -69.76 -34.16 15.13 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.684 2.256 . . . . 0.0 112.336 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.548 ' HA ' HD12 ' A' ' 696' ' ' LEU . 82.0 mtm180 -65.83 -16.1 63.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.858 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.432 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 33.0 t80 -70.0 -7.69 42.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.918 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 15.1 mt -118.13 12.14 13.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.907 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.568 HD13 ' OE1' ' A' ' 665' ' ' GLN . 90.6 mt -93.59 -23.26 18.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.785 HD21 ' HG3' ' A' ' 662' ' ' ARG . 30.8 mt -114.83 144.93 42.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -50.06 162.05 0.52 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.635 0.731 . . . . 0.0 110.9 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -31.1 21.07 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.659 2.239 . . . . 0.0 112.345 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 37.3 mtpt -72.16 -45.46 60.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.441 ' OE1' ' CE ' ' A' ' 663' ' ' MET . 18.8 mm-40 -60.12 -52.95 63.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.878 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.519 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 10.4 mtp180 -35.3 -48.64 0.47 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.839 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.27 -47.26 62.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.928 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -56.66 -60.77 3.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 94.2 t -55.31 -38.88 49.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.137 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.426 ' O ' HG23 ' A' ' 710' ' ' VAL . 43.1 t80 -62.93 -37.26 86.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.851 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -64.76 -58.01 7.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.845 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 708' ' ' GLN . . . . . 0.477 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 10.4 pt20 -53.87 -37.02 63.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.925 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.477 ' N ' ' HG3' ' A' ' 708' ' ' GLN . 2.6 t80 -63.87 -43.3 96.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.54 HG13 ' HB1' ' A' ' 677' ' ' ALA . 69.6 t -67.65 -45.08 85.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.104 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -53.25 -48.96 67.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.903 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.99 -34.77 77.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.168 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -66.79 -24.44 66.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.901 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.071 179.928 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.446 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.6 Cg_endo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.846 0.269 . . . . 0.0 112.336 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.407 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 15.7 tp -56.03 -48.08 76.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.927 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -54.69 -37.01 65.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.446 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -66.54 -69.78 0.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.05 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.412 ' HG3' HD21 ' A' ' 697' ' ' LEU . 6.8 ptt180 -49.35 -45.39 45.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.91 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.5 mtt -60.87 -45.09 95.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 1.3 mmmm -55.05 -44.03 74.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -60.48 -62.08 2.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.939 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.716 ' HB2' HD12 ' A' ' 697' ' ' LEU . 20.9 t80 -49.12 -53.02 22.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 35.0 tttt -54.6 -45.6 73.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -51.71 -44.52 63.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.89 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.4 ' O ' ' C ' ' A' ' 670' ' ' LEU . 8.4 mtm -62.3 -63.35 1.26 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.906 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 669' ' ' MET . 49.2 mt -38.49 -40.69 0.59 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 54.8 tp -75.9 -56.12 4.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 672' ' ' GLU . . . . . 0.475 ' O ' ' N ' ' A' ' 674' ' ' GLY . 8.2 mm-40 -59.23 -65.74 0.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 673' ' ' ARG . . . . . 0.41 ' HA ' ' NE ' ' A' ' 673' ' ' ARG . 14.1 mmp_? -39.22 -26.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.854 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 674' ' ' GLY . . . . . 0.475 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 86.44 34.61 11.71 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.503 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.738 HG13 ' HG3' ' A' ' 684' ' ' GLU . 76.7 t -60.29 99.07 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.868 0.366 . . . . 0.0 111.087 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 4.1 m -49.47 151.11 1.66 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -83.68 -26.69 29.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.103 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -102.01 48.12 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -123.97 -175.0 3.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.889 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 40.0 p -107.85 148.43 29.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.1 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 31.2 t-105 -59.56 -29.13 67.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -63.73 -53.69 47.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.831 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.519 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 10.8 mtpp -58.79 -59.06 6.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.738 ' HG3' HG13 ' A' ' 675' ' ' VAL . 64.6 mm-40 -55.32 -37.02 66.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 4.9 tp -54.53 -63.18 1.23 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.796 ' O ' HG12 ' A' ' 689' ' ' VAL . 5.6 p-80 -56.86 -29.26 62.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.809 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -68.13 -32.08 72.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.932 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 11.2 pt -112.78 9.94 8.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.108 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.796 HG12 ' O ' ' A' ' 686' ' ' HIS . 7.9 p -70.02 -24.66 26.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.131 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 10.4 p90 -80.08 -51.9 8.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.869 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.574 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 7.6 t70 -34.0 140.09 0.26 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.591 0.71 . . . . 0.0 110.904 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.67 -38.33 8.15 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.699 2.266 . . . . 0.0 112.357 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.468 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 28.7 mtm180 -65.56 -25.04 67.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.87 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.407 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 19.4 t80 -58.24 -11.59 2.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.897 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 30.9 mt -114.14 25.59 10.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.938 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.468 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 95.9 mt -109.52 -28.46 8.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.716 HD12 ' HB2' ' A' ' 666' ' ' PHE . 32.1 mt -103.21 139.37 38.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.971 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -48.5 162.62 0.35 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.598 0.713 . . . . 0.0 110.946 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -35.43 12.72 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.672 2.248 . . . . 0.0 112.348 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -72.15 -42.47 65.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.918 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 702' ' ' ARG . 26.4 mt-10 -60.0 -51.47 69.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.587 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 40.5 mtp180 -37.93 -51.04 1.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.871 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -66.09 -46.83 76.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.877 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -56.28 -61.06 2.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.882 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 84.6 t -56.19 -41.54 70.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.097 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.466 ' O ' HG23 ' A' ' 710' ' ' VAL . 21.9 t80 -60.32 -44.08 95.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -58.12 -48.07 81.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.853 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -61.11 -45.18 95.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.917 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.523 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 5.5 t80 -55.92 -44.95 78.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 706' ' ' PHE . 90.3 t -62.87 -51.91 65.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.134 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -45.98 -48.38 16.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.899 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.2 p -65.28 -46.54 80.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.145 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.523 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 12.5 mmp_? -59.22 -21.06 58.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.045 179.927 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.504 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.1 Cg_endo . . . . . 0 C--O 1.232 0.205 0 CA-C-O 120.818 0.258 . . . . 0.0 112.331 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 17.5 tp -57.81 -46.8 84.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -55.81 -32.17 63.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.92 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.504 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -70.84 -66.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.122 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.576 ' HG3' HD21 ' A' ' 697' ' ' LEU . 5.8 ptm180 -51.91 -48.84 63.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.913 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 9.1 mtt -57.52 -48.52 79.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.935 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -51.22 -44.71 61.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -59.24 -60.53 3.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.931 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.462 ' CE2' HD11 ' A' ' 670' ' ' LEU . 27.9 t80 -47.72 -59.9 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.88 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -46.24 -50.93 15.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.887 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -48.91 -48.14 42.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 3.8 mtm -56.37 -62.37 1.76 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.907 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.462 HD11 ' CE2' ' A' ' 666' ' ' PHE . 49.4 mt -41.23 -38.72 1.18 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 20.8 tp -72.52 -47.33 49.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.921 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 672' ' ' GLU . . . . . 0.425 ' O ' ' C ' ' A' ' 673' ' ' ARG . 12.3 mm-40 -71.69 -66.02 0.69 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.872 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 673' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 672' ' ' GLU . 13.2 mmt-85 -36.26 -39.26 0.17 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.875 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 100.01 29.61 6.75 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.531 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.621 HG12 ' O ' ' A' ' 675' ' ' VAL . 19.4 t -59.57 87.54 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.877 0.37 . . . . 0.0 111.126 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 676' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 675' ' ' VAL . 50.8 m -37.15 155.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.861 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -100.11 -4.82 28.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.06 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -117.03 36.3 4.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.889 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.1 m -125.13 -177.02 3.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.841 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 2.8 p -94.14 153.52 18.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.156 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.558 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 29.1 t-105 -63.09 -30.56 71.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.879 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.33 -57.17 13.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 9.2 mttp -56.2 -59.09 5.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.509 ' OE1' ' CZ ' ' A' ' 706' ' ' PHE . 8.1 mt-10 -55.4 -43.75 75.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.918 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.558 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 6.4 tp -47.35 -61.75 1.76 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.57 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.8 p-80 -56.32 -35.36 67.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.859 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.515 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 13.4 mtmt -63.67 -25.47 68.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.867 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 13.7 pt -121.07 11.84 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.143 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.57 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.3 p -80.29 -34.68 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.11 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.448 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 4.8 p90 -67.15 -43.28 82.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.906 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.448 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.5 t70 -46.58 139.72 6.11 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.563 0.696 . . . . 0.0 110.848 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.1 Cg_endo -69.74 -42.0 3.81 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.705 2.27 . . . . 0.0 112.318 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 19.6 mtm-85 -56.71 -23.57 43.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.576 ' CE2' ' HD3' ' A' ' 702' ' ' ARG . 0.8 OUTLIER -65.72 -30.12 70.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.911 -179.859 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.427 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 35.7 mt -78.73 -6.46 55.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.889 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.88 -52.74 10.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.576 HD21 ' HG3' ' A' ' 662' ' ' ARG . 11.7 mt -78.21 156.62 29.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -68.64 164.05 48.92 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.645 0.736 . . . . 0.0 110.857 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -35.41 12.73 Favored 'Trans proline' 0 N--CA 1.465 -0.176 0 C-N-CA 122.717 2.278 . . . . 0.0 112.38 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -72.44 -45.65 58.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.892 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.478 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -60.44 -53.47 57.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.576 ' HD3' ' CE2' ' A' ' 694' ' ' TYR . 68.7 mtt180 -34.49 -46.65 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.899 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 4.4 tmtm? -72.15 -46.23 57.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.841 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -56.26 -55.93 27.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.75 -48.41 81.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.158 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.689 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 19.2 t80 -55.43 -45.48 76.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.906 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -55.66 -47.7 76.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.845 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -64.53 -40.86 96.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.908 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.532 ' CZ ' ' HG3' ' A' ' 713' ' ' ARG . 11.7 t80 -63.95 -46.13 86.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.889 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.689 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 68.9 t -63.71 -48.92 84.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.092 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -51.89 -45.52 64.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -41.07 69.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.147 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.532 ' HG3' ' CZ ' ' A' ' 709' ' ' TYR . 4.7 mmp_? -59.23 -33.32 70.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.908 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.095 179.931 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.53 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.9 Cg_endo . . . . . 0 C--O 1.232 0.202 0 CA-C-O 120.852 0.271 . . . . 0.0 112.335 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 43.0 tp -59.42 -49.43 77.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -52.97 -36.58 60.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.53 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -68.69 -69.49 0.32 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.119 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.711 ' HG3' HD21 ' A' ' 697' ' ' LEU . 4.3 ptm180 -47.72 -53.27 15.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.919 ' HA ' HD11 ' A' ' 697' ' ' LEU . 11.4 mtt -53.24 -44.4 68.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.933 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -31.87 70.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -67.45 -59.32 3.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.83 ' HB2' HD12 ' A' ' 697' ' ' LEU . 26.5 t80 -55.03 -55.82 26.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.889 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 667' ' ' LYS . . . . . 0.518 ' HA ' HD12 ' A' ' 670' ' ' LEU . 0.2 OUTLIER -54.8 -44.31 73.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.865 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -52.15 -52.75 49.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.859 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.489 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 3.0 ptt? -67.73 -39.09 84.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.908 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 667' ' ' LYS . 24.9 mt -47.52 -46.98 28.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.925 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.7 tp -79.62 -48.2 14.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 672' ' ' GLU . . . . . 0.433 ' O ' ' N ' ' A' ' 674' ' ' GLY . 27.9 mm-40 -55.6 -66.02 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.897 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 9.1 mmp_? -42.76 -23.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.872 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 674' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 87.33 43.99 5.72 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.485 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.458 HG13 ' CG ' ' A' ' 684' ' ' GLU . 87.9 t -71.25 101.42 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.861 0.363 . . . . 0.0 111.18 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 3.2 t -61.35 154.93 22.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.891 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 677' ' ' ALA . . . . . 0.557 ' HA ' HG13 ' A' ' 710' ' ' VAL . . . -87.3 -47.88 8.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.089 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -58.56 -27.06 64.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 39.2 m -65.96 167.55 9.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 30.3 p -92.29 163.34 13.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.14 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 4.4 t-105 -67.31 -31.5 71.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.923 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -58.83 -56.9 16.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.846 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -56.52 -59.03 5.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.934 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.458 ' CG ' HG13 ' A' ' 675' ' ' VAL . 63.1 mm-40 -53.94 -40.68 67.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 5.7 tp -52.09 -59.12 4.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.932 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.7 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.6 p-80 -56.49 -33.31 65.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.83 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 48.0 mttt -65.56 -31.7 72.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 12.5 pt -112.83 11.07 8.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.11 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.7 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.3 p -76.69 -32.9 21.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.171 179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -74.99 -28.66 60.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.879 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.431 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 11.6 t70 -63.4 139.81 97.63 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.585 0.707 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.2 Cg_endo -69.77 -40.63 5.08 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.703 2.269 . . . . 0.0 112.324 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 36.7 mtm180 -57.99 -22.14 48.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.834 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.637 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 11.6 t80 -67.13 -3.56 7.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.94 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 28.2 mt -111.49 -13.95 13.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.904 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.56 -46.05 90.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.928 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.919 HD11 ' HA ' ' A' ' 663' ' ' MET . 30.1 mt -93.68 140.54 29.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -48.87 162.81 0.36 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.599 0.714 . . . . 0.0 110.924 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 699' ' ' PRO . . . . . 0.462 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.6 Cg_endo -69.76 -32.18 19.07 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.738 2.292 . . . . 0.0 112.338 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -72.23 -46.92 54.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.861 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.0 -49.84 75.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.879 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.637 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 56.8 mtm180 -42.66 -43.5 3.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.87 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -71.2 -42.86 68.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.903 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -60.4 -57.31 13.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 74.5 t -56.91 -43.69 80.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.118 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.677 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 20.9 t80 -61.74 -43.39 98.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.891 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -55.59 -49.0 73.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -63.47 -38.05 89.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.593 ' C ' ' CD1' ' A' ' 709' ' ' TYR . 0.3 OUTLIER -66.69 -38.15 86.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.927 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.677 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 99.4 t -72.98 -53.7 17.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.137 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -49.42 -51.61 34.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.888 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 10.6 p -66.25 -36.56 83.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.15 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.565 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 9.9 mmm180 -66.02 -34.35 77.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.884 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.082 179.92 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.61 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.1 Cg_endo . . . . . 0 C--O 1.232 0.196 0 CA-C-O 120.802 0.251 . . . . 0.0 112.345 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 21.4 tp -44.25 -36.56 2.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.933 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -71.24 -31.72 67.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.882 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.61 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -66.25 -55.79 14.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.121 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.457 ' HB2' ' CD2' ' A' ' 697' ' ' LEU . 0.0 OUTLIER -60.22 -54.87 40.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.869 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.833 ' HA ' HD11 ' A' ' 697' ' ' LEU . 16.1 mtt -51.05 -47.6 61.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.887 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.54 -45.43 73.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.921 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -59.69 -50.63 73.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.898 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.553 ' CE2' HD11 ' A' ' 670' ' ' LEU . 30.9 t80 -57.74 -58.98 5.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -51.14 -37.69 47.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.891 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -58.24 -52.52 65.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.852 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 693' ' ' ARG . 2.8 ptt? -67.31 -35.82 80.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.909 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' A' ' 666' ' ' PHE . 20.0 mt -52.45 -52.56 53.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.93 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 671' ' ' LEU . . . . . 0.407 HD13 ' HE ' ' A' ' 713' ' ' ARG . 13.2 tp -78.09 -43.16 29.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -55.31 -65.63 0.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.903 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 10.2 mmp_? -45.86 -26.14 0.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 92.12 38.36 5.72 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.518 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.608 HG13 ' CG ' ' A' ' 684' ' ' GLU . 42.0 t -61.06 112.47 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 111.17 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 16.1 m -70.22 127.51 33.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.878 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -67.97 -53.35 26.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.124 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -51.59 -32.32 28.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.934 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.3 m -62.08 -178.69 0.17 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.804 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 16.9 p -102.5 167.31 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.104 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.464 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 32.6 t-105 -66.9 -24.75 66.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.913 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -64.0 -63.12 1.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.916 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.01 -58.97 4.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.608 ' CG ' HG13 ' A' ' 675' ' ' VAL . 50.0 mm-40 -56.67 -44.63 81.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.866 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.464 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.4 tp -48.22 -50.49 29.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.982 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.764 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.2 p-80 -65.9 -33.87 76.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.577 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 51.7 mttt -65.94 -23.6 66.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.832 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 7.2 pt -117.8 3.17 7.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.182 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.764 HG12 ' O ' ' A' ' 686' ' ' HIS . 7.9 p -68.2 -33.13 58.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.099 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -84.26 5.29 27.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.876 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.488 ' OD1' ' N ' ' A' ' 693' ' ' ARG . 4.7 t70 -92.72 142.63 25.91 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.625 0.726 . . . . 0.0 110.862 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.418 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.9 Cg_endo -69.72 -47.84 0.86 Allowed 'Trans proline' 0 N--CA 1.465 -0.197 0 C-N-CA 122.705 2.27 . . . . 0.0 112.385 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.493 ' HA ' HD12 ' A' ' 696' ' ' LEU . 79.1 mtm180 -53.07 -25.29 12.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.469 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 19.6 t80 -65.66 -5.23 7.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.923 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 30.8 mt -118.05 10.95 13.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.905 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' A' ' 693' ' ' ARG . 94.1 mt -94.12 -31.79 14.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.833 HD11 ' HA ' ' A' ' 663' ' ' MET . 40.1 mt -102.56 141.09 35.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.969 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 -47.5 162.36 0.3 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.667 0.746 . . . . 0.0 110.853 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 699' ' ' PRO . . . . . 0.42 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.0 Cg_endo -69.72 -34.16 15.27 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.651 2.234 . . . . 0.0 112.374 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -72.27 -44.56 62.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.461 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -62.02 -49.64 75.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.432 ' NH1' ' O ' ' A' ' 694' ' ' TYR . 43.3 mtm180 -42.7 -44.69 4.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.903 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 7.7 tppt? -69.3 -46.33 67.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -57.03 -55.07 39.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.881 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.6 t -58.68 -37.47 65.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.105 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.567 ' O ' HG23 ' A' ' 710' ' ' VAL . 75.0 t80 -67.27 -34.6 77.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -64.7 -54.22 34.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.883 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 708' ' ' GLN . . . . . 0.461 ' CG ' ' N ' ' A' ' 709' ' ' TYR . 7.6 pt20 -57.84 -45.38 86.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.941 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.693 ' CD2' ' CZ ' ' A' ' 713' ' ' ARG . 2.7 t80 -56.99 -52.71 64.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.922 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 706' ' ' PHE . 92.3 t -59.66 -39.23 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.168 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -53.54 -51.25 63.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.967 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 712' ' ' THR . . . . . 0.436 ' O ' ' N ' ' A' ' 714' ' ' ALA . 20.3 p -70.03 -67.12 0.51 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.156 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.693 ' CZ ' ' CD2' ' A' ' 709' ' ' TYR . 10.4 mpt_? -42.34 -23.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.869 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 714' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 712' ' ' THR . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.1 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 658' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.167 0 CA-C-O 120.879 0.283 . . . . 0.0 112.3 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 25.6 tp -56.07 -47.29 78.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 660' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 661' ' ' ALA . 8.1 pt-20 -56.35 -36.0 68.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 661' ' ' ALA . . . . . 0.536 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -68.39 -71.04 0.23 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.105 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -46.92 -48.96 21.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.839 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.436 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.4 mtt -55.25 -49.09 72.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.859 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.71 -48.23 50.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.939 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 665' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' A' ' 669' ' ' MET . 72.5 mt-30 -56.7 -61.21 2.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.901 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.557 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 21.2 t80 -43.53 -60.62 1.67 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -51.04 -47.71 61.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.902 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -50.18 -41.15 48.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.915 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.403 ' HG3' ' O ' ' A' ' 665' ' ' GLN . 4.4 mtm -65.4 -63.42 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.864 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 57.3 mt -39.38 -40.11 0.76 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.919 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 19.8 tp -76.64 -45.9 28.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.928 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -65.22 -62.77 1.34 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -46.23 -21.81 0.19 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.898 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 84.29 42.68 7.36 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.506 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.66 HG13 ' CG ' ' A' ' 684' ' ' GLU . 37.3 t -70.01 100.61 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.837 0.351 . . . . 0.0 111.115 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 20.3 m -56.2 141.22 41.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.843 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -77.85 -37.87 47.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.07 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -81.47 44.92 0.83 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.902 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.7 m -133.67 -177.2 4.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.896 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 680' ' ' THR . . . . . 0.626 HG23 ' H ' ' A' ' 683' ' ' LYS . 5.2 t -99.1 154.14 18.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.154 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.558 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 3.3 t-105 -65.47 -32.63 74.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -57.97 -48.89 78.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.918 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.626 ' H ' HG23 ' A' ' 680' ' ' THR . 32.4 mttm -62.85 -59.02 5.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.909 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.66 ' CG ' HG13 ' A' ' 675' ' ' VAL . 56.0 mm-40 -55.76 -37.3 68.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.558 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 8.0 tp -56.58 -62.94 1.38 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.919 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.756 ' O ' HG12 ' A' ' 689' ' ' VAL . 2.1 p-80 -51.72 -36.01 45.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.582 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 37.5 mttm -64.26 -33.47 75.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.918 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 23.9 pt -108.09 10.06 9.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.092 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.756 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.3 p -78.17 -11.71 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.115 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.424 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 11.4 p90 -90.49 -41.61 11.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.879 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.424 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 10.6 t70 -53.59 139.8 48.77 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.595 0.712 . . . . 0.0 110.875 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.8 Cg_endo -69.76 -42.49 3.35 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.659 2.239 . . . . 0.0 112.372 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.459 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 22.4 mtm-85 -53.41 -20.66 4.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.897 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.576 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 40.3 t80 -63.3 -25.56 68.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.884 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 28.6 mt -85.73 -20.26 29.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.944 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.459 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 78.8 mt -59.27 -47.65 84.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.967 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 663' ' ' MET . 10.8 mt -85.18 145.1 27.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.884 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -60.55 164.16 7.65 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.646 0.736 . . . . 0.0 110.861 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 699' ' ' PRO . . . . . 0.415 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.2 Cg_endo -69.67 -34.05 15.66 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.642 2.228 . . . . 0.0 112.394 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -72.38 -47.03 52.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.414 ' O ' ' C ' ' A' ' 702' ' ' ARG . 6.0 mm-40 -61.46 -54.17 46.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.821 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.576 ' NH1' ' CE2' ' A' ' 694' ' ' TYR . 30.6 mtm180 -37.1 -45.04 0.58 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.924 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 3.2 tppt? -70.27 -45.8 65.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.924 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -60.84 -58.98 6.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.887 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 44.1 t -50.68 -52.54 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.146 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.412 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 20.2 t80 -51.1 -55.14 19.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.858 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -45.49 -51.18 12.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -60.63 -44.42 96.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.939 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.467 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 1.5 t80 -56.97 -42.63 80.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.951 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.412 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 85.0 t -66.3 -39.3 83.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.137 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 46.9 tttt -58.82 -41.34 86.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.87 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.8 p -73.74 -41.68 62.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.477 ' HA ' ' CZ ' ' A' ' 713' ' ' ARG . 0.1 OUTLIER -66.3 -27.0 67.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.861 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.102 179.949 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--O 1.232 0.204 0 CA-C-O 120.796 0.248 . . . . 0.0 112.33 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 36.2 tp -53.48 -47.35 69.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.912 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 660' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 1.5 mp0 -56.53 -34.2 66.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.874 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.97 -67.93 0.43 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.046 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 662' ' ' ARG . . . . . 0.471 ' HE ' HD23 ' A' ' 697' ' ' LEU . 6.4 ptm180 -48.62 -55.69 10.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.921 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.9 mtt -54.15 -47.18 72.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.867 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 664' ' ' LYS . . . . . 0.439 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 11.7 mmmt -51.18 -48.88 61.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.869 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -56.44 -60.72 3.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.933 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 666' ' ' PHE . . . . . 0.477 ' CE2' HD11 ' A' ' 670' ' ' LEU . 19.3 t80 -46.41 -62.01 1.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 57.5 tttt -47.55 -49.18 27.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.914 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -47.62 -49.63 26.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.867 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 669' ' ' MET . . . . . 0.454 ' O ' ' N ' ' A' ' 672' ' ' GLU . 4.6 mtm -59.07 -64.51 0.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.849 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 670' ' ' LEU . . . . . 0.477 HD11 ' CE2' ' A' ' 666' ' ' PHE . 50.4 mt -37.54 -41.7 0.48 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.916 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 23.4 tp -76.8 -38.76 53.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.909 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 672' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' A' ' 669' ' ' MET . 5.7 mm-40 -73.29 -65.98 0.74 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.888 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 673' ' ' ARG . . . . . 0.434 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 5.4 mmp_? -39.63 -33.91 0.21 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.837 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 97.89 25.09 10.87 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.48 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 675' ' ' VAL . . . . . 0.624 HG13 ' CD ' ' A' ' 684' ' ' GLU . 39.8 t -51.82 97.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.84 0.353 . . . . 0.0 111.103 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 43.4 m -54.75 132.14 45.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -64.95 -47.55 77.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.098 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -76.85 48.02 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.867 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.3 t -130.84 176.61 8.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.901 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 61.1 p -94.51 142.1 27.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.107 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 681' ' ' TRP . . . . . 0.521 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 34.9 t-105 -57.12 -31.65 65.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.964 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -60.32 -56.01 26.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.881 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 683' ' ' LYS . . . . . 0.603 ' HA ' ' CD2' ' A' ' 686' ' ' HIS . 44.6 mttt -57.99 -59.01 5.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.908 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 684' ' ' GLU . . . . . 0.624 ' CD ' HG13 ' A' ' 675' ' ' VAL . 21.6 mm-40 -56.04 -41.04 74.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.898 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 685' ' ' LEU . . . . . 0.521 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 9.4 tp -50.63 -58.88 4.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.935 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 686' ' ' HIS . . . . . 0.603 ' CD2' ' HA ' ' A' ' 683' ' ' LYS . 5.0 p80 -60.62 -29.96 69.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.86 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 687' ' ' LYS . . . . . 0.442 ' HG3' ' CE1' ' A' ' 686' ' ' HIS . 66.4 mttt -67.03 -27.59 67.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.943 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 13.1 pt -117.97 8.3 6.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.104 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.588 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.0 p -74.84 -28.36 21.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.157 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 690' ' ' PHE . . . . . 0.465 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 13.6 p90 -73.49 -44.53 57.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.845 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 691' ' ' ASP . . . . . 0.465 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.8 t70 -40.82 139.77 1.14 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.627 0.727 . . . . 0.0 110.861 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 692' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.77 -39.17 6.8 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.679 2.253 . . . . 0.0 112.339 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 693' ' ' ARG . . . . . 0.477 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 79.4 mtm180 -61.36 -27.19 68.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.809 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 694' ' ' TYR . . . . . 0.519 ' CD1' ' C ' ' A' ' 694' ' ' TYR . 1.4 t80 -62.7 -23.62 67.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.923 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.418 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 20.2 mt -91.17 9.26 31.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.953 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 696' ' ' LEU . . . . . 0.477 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 89.6 mt -89.77 -40.84 12.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 697' ' ' LEU . . . . . 0.471 HD23 ' HE ' ' A' ' 662' ' ' ARG . 60.7 mt -91.97 166.0 12.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.894 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 698' ' ' ASN . . . . . 0.503 ' ND2' ' OE2' ' A' ' 701' ' ' GLU . 0.2 OUTLIER -78.58 165.39 50.1 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.623 0.725 . . . . 0.0 110.89 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 699' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 698' ' ' ASN . 53.7 Cg_endo -69.77 -26.11 27.88 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.725 2.283 . . . . 0.0 112.353 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -72.47 -47.8 45.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.915 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 701' ' ' GLU . . . . . 0.503 ' OE2' ' ND2' ' A' ' 698' ' ' ASN . 0.0 OUTLIER -66.17 -52.75 45.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.887 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 702' ' ' ARG . . . . . 0.449 ' NH2' ' O ' ' A' ' 697' ' ' LEU . 79.8 mtt180 -35.13 -44.66 0.26 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.874 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 19.3 tptp -74.48 -48.76 25.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -55.81 -57.73 10.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.94 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 89.9 t -56.71 -49.86 76.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.112 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 706' ' ' PHE . . . . . 0.512 ' CD2' ' CE3' ' A' ' 681' ' ' TRP . 20.1 t80 -53.22 -41.15 65.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.85 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.37 -46.19 91.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.866 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -61.03 -39.86 91.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.916 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 709' ' ' TYR . . . . . 0.461 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 22.7 t80 -63.06 -43.25 99.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.917 -179.871 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 710' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 706' ' ' PHE . 86.8 t -63.49 -48.93 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.087 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 35.9 tttt -54.11 -48.54 70.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 2.3 p -66.58 -37.25 84.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.159 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 713' ' ' ARG . . . . . 0.461 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.2 mmm180 -66.54 -28.24 68.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.156 179.892 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 N-CA-C 112.454 -0.259 . . . . 0.0 112.454 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 2.0 m 44.87 42.27 5.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.881 0.372 . . . . 0.0 110.845 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 35.5 t -89.72 136.93 32.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 77.0 101.6 0.16 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.47 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 60.3 p -45.09 119.98 2.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.882 0.373 . . . . 0.0 110.891 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 38.3 m -46.7 -50.73 17.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.864 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 650' ' ' GLY . . . . . 0.413 ' O ' ' C ' ' A' ' 651' ' ' ALA . . . 158.2 46.51 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.442 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 651' ' ' ALA . . . . . 0.413 ' C ' ' O ' ' A' ' 650' ' ' GLY . . . -36.91 112.79 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 0.0 111.122 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -56.92 -32.58 66.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -104.02 176.95 4.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.911 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -80.91 -64.01 1.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.915 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -122.0 25.24 9.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.108 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 94.6 mt -121.67 112.7 36.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.13 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 6.2 m -52.46 144.16 24.69 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.617 0.722 . . . . 0.0 111.141 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.514 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo -69.73 163.08 39.57 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.686 2.257 . . . . 0.0 112.347 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 14.8 tp -56.02 -47.3 78.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -58.01 -33.69 69.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.867 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.514 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -67.45 -67.17 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.104 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.806 ' HG3' HD21 ' A' ' 697' ' ' LEU . 14.9 ptt180 -53.82 -47.22 71.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.849 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.436 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.3 mtt -54.99 -41.35 71.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -61.58 -43.48 98.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -57.47 -57.89 10.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.951 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.635 ' CD1' ' HE2' ' A' ' 669' ' ' MET . 25.1 t80 -51.99 -52.49 50.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.898 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.406 ' HA ' HD12 ' A' ' 670' ' ' LEU . 12.4 ttmt -55.89 -37.21 68.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.905 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.86 -52.16 66.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.838 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.635 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 2.8 ptt? -66.92 -37.46 84.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.454 HD11 ' CE2' ' A' ' 666' ' ' PHE . 29.6 mt -52.25 -48.86 64.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.938 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.8 tp -77.5 -45.75 24.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -57.1 -66.04 0.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 10.4 mmp_? -43.76 -25.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.872 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 89.2 43.84 5.19 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.515 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.452 HG13 ' CG ' ' A' ' 684' ' ' GLU . 40.4 t -68.06 97.87 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.853 0.359 . . . . 0.0 111.128 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 8.7 t -51.42 143.92 10.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.815 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -80.89 -42.08 22.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.133 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -82.94 47.67 1.25 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.885 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.8 m -131.9 -178.62 4.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.856 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 680' ' ' THR . . . . . 0.482 HG23 ' H ' ' A' ' 683' ' ' LYS . 1.7 t -101.7 151.45 22.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.125 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.411 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 26.1 t-105 -59.43 -25.59 64.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.957 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.58 -56.64 14.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.904 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.482 ' H ' HG23 ' A' ' 680' ' ' THR . 38.4 mttp -56.13 -59.04 5.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.882 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.452 ' CG ' HG13 ' A' ' 675' ' ' VAL . 37.7 mm-40 -54.92 -40.6 70.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.908 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.411 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 11.7 tp -51.77 -59.41 4.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.883 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.594 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.1 p-80 -59.2 -29.81 67.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.475 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 45.9 mttm -68.03 -28.12 67.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.849 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 25.3 pt -117.88 10.45 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.113 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.594 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.7 p -74.4 -37.6 45.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.091 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.475 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 7.2 p90 -80.5 9.41 6.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.868 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.423 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 10.0 t70 -93.68 139.81 22.88 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.595 0.712 . . . . 0.0 110.858 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.9 Cg_endo -69.8 -43.06 2.85 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.671 2.247 . . . . 0.0 112.358 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.479 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 70.9 mtm180 -58.47 -21.66 52.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.644 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 1.8 t80 -67.04 -18.69 65.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 12.2 mt -97.29 7.26 46.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.479 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 83.4 mt -91.13 -31.2 16.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.806 HD21 ' HG3' ' A' ' 662' ' ' ARG . 27.2 mt -104.12 152.39 22.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.894 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -57.31 161.86 4.99 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.693 0.758 . . . . 0.0 110.887 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 -37.23 9.52 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.696 2.264 . . . . 0.0 112.362 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -72.1 -45.52 60.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' A' ' 702' ' ' ARG . 36.9 mt-10 -56.95 -53.15 61.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.899 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.644 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 47.5 mtt180 -36.28 -52.24 0.8 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.837 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -65.38 -45.07 85.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -56.35 -57.89 10.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.04 -29.98 42.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.109 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.411 ' O ' HG23 ' A' ' 710' ' ' VAL . 43.1 t80 -71.08 -47.95 55.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -55.89 -52.64 63.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.881 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -60.33 -41.8 94.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.893 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -58.99 -41.22 87.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.858 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 706' ' ' PHE . 78.2 t -68.95 -43.04 82.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.067 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -53.23 -51.25 62.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.894 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 47.3 p -66.74 -35.73 80.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.149 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.409 ' HA ' ' NE ' ' A' ' 713' ' ' ARG . 5.0 mmp_? -66.45 -29.47 69.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -83.2 -46.45 12.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.14 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 715' ' ' GLU . . . . . 0.408 ' O ' ' N ' ' A' ' 717' ' ' GLU . 4.5 pt-20 -57.72 -41.98 82.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.871 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -41.1 -27.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.886 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 717' ' ' GLU . . . . . 0.454 ' O ' ' C ' ' A' ' 718' ' ' ARG . 8.9 tt0 -57.99 -51.39 69.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.842 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 718' ' ' ARG . . . . . 0.454 ' C ' ' O ' ' A' ' 717' ' ' GLU . 5.4 ttt180 -34.28 -41.52 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.859 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -67.15 145.14 55.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.919 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 79.3 p -40.06 -49.56 2.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.885 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 149.25 174.86 21.12 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.502 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -4.79 14.74 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.704 2.269 . . . . 0.0 112.36 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 41.3 p -52.82 137.8 31.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 4.6 p -137.35 129.52 29.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.906 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.263 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.459 -179.942 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 112.536 -0.226 . . . . 0.0 112.536 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 70.4 m -156.83 148.82 22.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.859 0.362 . . . . 0.0 110.832 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 53.8 p -139.82 173.11 11.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.822 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 161.44 111.57 0.27 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.509 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 3.1 t -158.12 116.14 3.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.893 0.378 . . . . 0.0 110.879 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 66.5 m -78.48 137.05 37.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.88 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -171.53 53.65 0.18 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.487 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -138.07 122.97 18.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.788 0.328 . . . . 0.0 111.086 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -58.82 -47.68 83.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.852 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -69.25 85.2 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 654' ' ' ARG . . . . . 0.455 ' HB2' ' CZ ' ' A' ' 654' ' ' ARG . 3.4 ptm85 -58.73 147.37 33.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.867 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -88.57 151.99 22.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 36.7 mm -120.16 106.16 18.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.154 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 657' ' ' VAL . . . . . 0.521 ' HB ' ' HB3' ' A' ' 661' ' ' ALA . 3.2 m -63.77 153.94 82.3 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.653 0.74 . . . . 0.0 111.105 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.401 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.1 Cg_endo -69.78 155.33 66.14 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.637 2.225 . . . . 0.0 112.335 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 26.4 tp -46.22 -47.58 17.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.933 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -57.65 -35.68 70.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.909 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.521 ' HB3' ' HB ' ' A' ' 657' ' ' VAL . . . -67.68 -70.46 0.26 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.104 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.635 ' HG3' HD21 ' A' ' 697' ' ' LEU . 5.2 ptm180 -46.8 -51.63 16.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.885 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.693 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.1 mtt -56.97 -50.1 73.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.87 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -51.25 -41.83 60.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.899 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -61.49 -65.45 0.69 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.912 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.751 ' HB2' HD12 ' A' ' 697' ' ' LEU . 21.6 t80 -44.81 -49.12 10.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 43.7 tttt -63.22 -42.26 99.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -52.83 -36.39 58.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.41 ' HG2' ' NH1' ' A' ' 693' ' ' ARG . 6.3 mtm -73.81 -60.54 2.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 54.3 mt -39.23 -42.32 0.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.948 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.2 tp -78.46 -50.45 11.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.918 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -59.73 -65.91 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.858 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -41.83 -32.84 0.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.896 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 96.24 31.4 7.24 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.489 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.79 HG13 ' HG2' ' A' ' 684' ' ' GLU . 69.6 t -55.11 103.44 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.874 0.368 . . . . 0.0 111.116 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 59.3 m -59.3 137.51 57.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -72.96 1.6 8.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.092 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -121.86 24.02 9.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.88 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.6 t -105.72 161.95 13.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.839 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 11.5 p -88.66 147.8 24.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.172 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.492 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 56.1 t-105 -50.98 -28.07 9.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.9 -61.74 2.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.896 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.569 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 0.6 OUTLIER -54.54 -59.06 5.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.79 ' HG2' HG13 ' A' ' 675' ' ' VAL . 9.0 mt-10 -54.8 -41.05 70.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.916 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.492 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 8.1 tp -52.43 -68.59 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.569 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 4.4 p-80 -50.18 -31.64 14.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.861 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.401 ' HG3' ' NE2' ' A' ' 686' ' ' HIS . 45.6 mttt -68.35 -28.29 67.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 24.3 pt -119.15 15.48 6.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.14 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.498 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -83.85 -39.36 14.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.141 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.409 ' N ' ' CG1' ' A' ' 689' ' ' VAL . 15.4 p90 -68.24 -20.93 64.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.868 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.42 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.6 t70 -72.11 139.75 82.47 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.619 0.723 . . . . 0.0 110.873 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.77 -38.74 7.36 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.681 2.254 . . . . 0.0 112.367 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.551 ' HA ' HD12 ' A' ' 696' ' ' LEU . 59.4 mtm180 -53.84 -27.49 30.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.868 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.644 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 15.7 t80 -63.0 -23.41 67.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.93 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 17.4 mt -100.75 18.03 20.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.95 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 693' ' ' ARG . 74.2 mt -99.93 -41.53 7.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.909 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.751 HD12 ' HB2' ' A' ' 666' ' ' PHE . 29.2 mt -89.67 146.51 24.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.904 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 9.6 m-20 -47.09 161.47 0.3 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.627 0.727 . . . . 0.0 110.895 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -37.04 9.83 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.698 2.265 . . . . 0.0 112.34 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.02 -37.69 69.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.948 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.437 ' O ' ' C ' ' A' ' 702' ' ' ARG . 8.3 mt-10 -62.53 -55.3 28.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.879 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.644 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 50.1 mtm180 -34.5 -47.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.862 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 9.4 tppt? -71.2 -46.95 60.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.885 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 12.1 mm100 -57.88 -59.98 4.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.901 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 96.1 t -52.62 -50.72 39.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.13 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.413 ' CZ ' ' OE1' ' A' ' 684' ' ' GLU . 20.9 t80 -49.11 -46.06 44.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.898 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -57.8 -54.78 43.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.881 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -52.84 -47.3 67.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.895 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.531 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 12.3 t80 -52.53 -51.03 61.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.951 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 41.1 t -58.02 -50.7 77.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.115 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -44.69 -56.42 4.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.908 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 39.7 p -60.35 -47.33 86.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.116 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.531 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.1 mmm180 -54.72 -21.73 11.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -85.59 -54.36 4.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.054 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -52.28 -36.12 52.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.908 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -84.63 22.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.916 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -64.48 104.0 0.73 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.923 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -67.9 156.56 36.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.906 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -86.8 -58.35 2.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.843 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 37.8 t -100.92 41.73 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.842 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -99.81 177.94 29.46 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.494 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 93.23 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.682 2.255 . . . . 0.0 112.334 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 63.8 m -147.73 152.91 38.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 89.6 p -64.57 111.17 2.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.832 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.5 -179.999 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.308 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 81.3 p -81.87 112.06 18.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.909 0.385 . . . . 0.0 110.873 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 31.0 t -57.44 -48.71 78.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.812 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 109.03 -72.03 0.2 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.481 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 84.8 p -114.77 109.53 18.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.858 0.361 . . . . 0.0 110.863 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 35.2 t -124.24 107.56 11.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.79 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -149.41 101.3 0.22 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.486 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -104.73 79.67 1.56 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.805 0.336 . . . . 0.0 111.118 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -109.44 174.28 5.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -85.76 -59.09 2.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.925 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -127.94 121.73 30.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -134.03 118.03 17.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.065 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 73.6 mt -79.93 96.42 2.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.138 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 657' ' ' VAL . . . . . 0.507 HG23 ' HD2' ' A' ' 658' ' ' PRO . 5.4 p -47.96 134.68 11.51 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.605 0.717 . . . . 0.0 111.138 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.551 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.5 Cg_endo -69.8 156.69 62.61 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.67 2.247 . . . . 0.0 112.329 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 17.7 tp -58.78 -50.72 72.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 660' ' ' GLU . . . . . 0.47 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 6.0 tp10 -51.26 -34.43 32.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.551 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -70.62 -71.07 0.26 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.085 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -48.01 -49.79 29.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.864 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.682 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.9 mtt -55.91 -45.7 78.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.878 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 664' ' ' LYS . . . . . 0.47 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 8.5 mmmt -55.83 -42.26 75.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.4 -56.52 21.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.589 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 25.8 t80 -50.15 -49.71 51.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 33.8 tttt -62.16 -36.71 82.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -45.21 92.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.866 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.459 ' CG ' ' O ' ' A' ' 666' ' ' PHE . 3.0 ptt? -72.26 -38.67 68.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.9 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 25.3 mt -52.17 -47.49 65.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.954 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 22.0 tp -77.02 -50.36 13.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.94 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -53.19 -66.05 0.45 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.885 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -43.95 -31.36 0.87 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.874 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 96.25 45.9 2.7 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.502 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.408 HG13 ' CG ' ' A' ' 684' ' ' GLU . 74.7 t -72.4 89.57 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.857 0.36 . . . . 0.0 111.12 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 41.9 m -56.83 123.84 16.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.871 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 677' ' ' ALA . . . . . 0.86 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -56.62 -31.8 64.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.072 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -70.0 -22.88 63.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.871 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 24.5 t -67.1 173.62 3.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.845 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 25.2 p -104.42 158.21 16.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.165 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.461 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 44.9 t-105 -59.87 -33.19 71.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -60.97 -58.6 7.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.92 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.489 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 63.6 mttt -57.15 -59.06 5.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.843 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.408 ' CG ' HG13 ' A' ' 675' ' ' VAL . 13.2 mt-10 -55.5 -38.28 68.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.853 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.461 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 5.1 tp -53.5 -52.95 57.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.933 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.796 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.0 p-80 -65.52 -29.12 69.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 61.7 mttt -68.72 -33.28 73.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.949 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 688' ' ' ILE . . . . . 0.417 ' O ' ' CB ' ' A' ' 694' ' ' TYR . 7.5 pt -111.04 6.91 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.137 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.796 HG12 ' O ' ' A' ' 686' ' ' HIS . 8.0 p -66.03 -25.07 35.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.14 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.514 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 9.1 p90 -85.52 -47.15 10.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.514 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.4 t70 -34.28 142.05 0.23 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.626 0.727 . . . . 0.0 110.829 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.414 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.76 -39.32 6.66 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.715 2.276 . . . . 0.0 112.358 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.505 ' HA ' HD12 ' A' ' 696' ' ' LEU . 11.9 mtm-85 -67.19 -21.58 65.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.859 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.417 ' CB ' ' O ' ' A' ' 688' ' ' ILE . 18.8 t80 -63.96 -18.77 64.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 18.9 mt -109.9 23.53 14.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.948 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 693' ' ' ARG . 81.3 mt -105.12 -25.6 12.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.907 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.682 HD11 ' HA ' ' A' ' 663' ' ' MET . 27.9 mt -110.5 144.56 39.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.895 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -50.75 163.12 0.5 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.584 0.707 . . . . 0.0 110.893 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -31.7 20.02 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.706 2.271 . . . . 0.0 112.299 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -45.04 61.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.902 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 5.5 mm-40 -59.07 -54.53 46.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.907 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.589 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 38.1 mtp180 -34.28 -50.43 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -68.0 -45.67 73.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 704' ' ' GLN . . . . . 0.409 ' N ' ' O ' ' A' ' 701' ' ' GLU . 10.9 mm-40 -58.23 -60.32 3.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.913 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.4 t -54.71 -46.63 73.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.167 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.674 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 25.2 t80 -60.76 -41.4 95.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.907 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -54.92 -53.03 60.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.833 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -61.64 -39.04 89.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.929 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -63.99 -39.07 93.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.937 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.86 HG13 ' HB1' ' A' ' 677' ' ' ALA . 86.6 t -69.6 -53.92 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.114 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 12.8 mtpp -48.14 -48.47 34.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 45.3 p -66.85 -38.95 87.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 12.6 mmt-85 -62.19 -47.16 85.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -74.29 -54.56 7.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.104 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -51.1 -28.25 10.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.905 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -96.46 27.76 3.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.921 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.16 119.79 4.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.894 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 718' ' ' ARG . . . . . 0.479 ' HB2' ' CZ ' ' A' ' 718' ' ' ARG . 12.1 mtm105 -111.53 96.19 5.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 719' ' ' ARG . . . . . 0.439 ' NE ' ' HA ' ' A' ' 719' ' ' ARG . 11.3 mmp_? -70.31 172.95 7.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.845 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 11.1 p -90.12 148.46 22.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.829 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -124.19 -94.92 1.1 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.476 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 -7.31 20.74 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.679 2.253 . . . . 0.0 112.299 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 27.1 m -99.11 142.38 30.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.886 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 3.5 m -156.09 159.67 39.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.857 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.505 -179.974 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 49.4 m -130.89 82.11 2.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.853 0.359 . . . . 0.0 110.908 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 2.5 t -38.34 104.97 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.865 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 128.73 127.38 2.96 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.508 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 23.3 m -144.31 171.23 14.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.899 0.38 . . . . 0.0 110.85 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 23.2 t 52.2 43.69 30.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.851 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -149.32 151.79 23.87 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.46 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -43.0 101.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.764 0.316 . . . . 0.0 111.086 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 60.4 mtt-85 -89.65 154.18 20.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.863 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.3 131.43 42.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.889 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 13.3 mtp85 -129.87 -53.23 1.14 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.907 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -118.06 50.78 1.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.087 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 656' ' ' ILE . . . . . 0.403 ' O ' ' HD3' ' A' ' 658' ' ' PRO . 8.0 mm -132.98 95.43 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.133 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 657' ' ' VAL . . . . . 0.68 ' O ' HG13 ' A' ' 657' ' ' VAL . 12.2 p -101.28 98.35 8.86 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.664 0.745 . . . . 0.0 111.12 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.488 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo -69.8 156.44 63.24 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.684 2.256 . . . . 0.0 112.323 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 21.9 tp -59.99 -48.82 80.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -51.95 -32.76 34.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.855 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.488 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -74.0 -68.83 0.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.087 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.564 ' HG3' HD21 ' A' ' 697' ' ' LEU . 6.5 ptm180 -48.7 -48.36 40.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.891 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.766 ' HA ' HD11 ' A' ' 697' ' ' LEU . 9.2 mtt -59.05 -51.26 70.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -50.39 -39.37 46.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -63.24 -58.16 8.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.862 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.723 ' HB2' HD12 ' A' ' 697' ' ' LEU . 23.2 t80 -51.9 -43.95 63.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.897 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 34.0 tttp -69.7 -39.25 77.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.859 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -57.67 -43.32 84.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.871 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -71.99 -37.95 69.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.892 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.49 HD23 HG21 ' A' ' 675' ' ' VAL . 27.1 mt -53.86 -46.54 71.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 42.9 tp -75.46 -51.28 13.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.953 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -54.85 -63.62 1.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 12.7 mmp_? -45.78 -24.29 0.36 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.881 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 86.44 44.42 5.87 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.527 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.61 HG13 ' CD ' ' A' ' 684' ' ' GLU . 54.9 t -70.11 107.81 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.812 0.339 . . . . 0.0 111.162 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 39.1 m -63.36 149.87 44.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 677' ' ' ALA . . . . . 0.604 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -81.4 -52.94 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.131 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -57.79 -13.55 4.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.892 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -75.03 172.37 12.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.862 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 2.4 t -105.25 165.14 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.186 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.49 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 40.6 t-105 -62.73 -26.52 68.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -61.47 -62.11 2.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.405 ' O ' ' ND1' ' A' ' 686' ' ' HIS . 39.8 mttp -53.52 -58.94 5.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.914 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.61 ' CD ' HG13 ' A' ' 675' ' ' VAL . 46.7 mm-40 -55.48 -45.79 76.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.903 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.49 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.7 tp -45.59 -55.11 6.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.906 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.707 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.7 p-80 -64.13 -31.63 72.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.856 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.552 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 56.9 mttm -68.97 -22.84 64.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 8.7 pt -118.48 5.0 6.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.119 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.707 HG12 ' O ' ' A' ' 686' ' ' HIS . 7.9 p -69.9 -27.95 34.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.141 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.552 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 6.7 p90 -86.1 3.66 41.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 693' ' ' ARG . 9.4 t70 -94.96 139.8 22.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.605 0.717 . . . . 0.0 110.864 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.8 -34.02 15.3 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.675 2.25 . . . . 0.0 112.323 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.624 ' HA ' HD12 ' A' ' 696' ' ' LEU . 16.8 mtm-85 -67.49 -20.03 65.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.881 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 694' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -65.8 -16.96 64.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.969 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.1 mt -113.27 16.84 18.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.921 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.624 HD12 ' HA ' ' A' ' 693' ' ' ARG . 54.8 mt -96.03 -19.68 19.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.846 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.766 HD11 ' HA ' ' A' ' 663' ' ' MET . 30.8 mt -114.83 148.19 38.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.884 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 -50.1 161.91 0.54 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.6 0.715 . . . . 0.0 110.93 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -33.71 15.93 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.652 2.235 . . . . 0.0 112.288 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -72.01 -45.31 61.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.892 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 71.6 mm-40 -57.47 -53.47 57.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.585 ' HG2' ' CE2' ' A' ' 666' ' ' PHE . 10.7 mtp180 -34.42 -47.95 0.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -71.45 -45.35 62.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.892 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 704' ' ' GLN . . . . . 0.41 ' N ' ' O ' ' A' ' 701' ' ' GLU . 46.0 mm-40 -57.88 -59.26 5.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.906 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 91.6 t -55.62 -48.37 77.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.126 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.436 ' O ' HG23 ' A' ' 710' ' ' VAL . 26.4 t80 -56.34 -43.8 79.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.917 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -55.32 -53.24 58.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.863 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -58.08 -38.83 77.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.887 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -62.8 -42.78 99.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.917 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.604 HG13 ' HB1' ' A' ' 677' ' ' ALA . 89.2 t -67.36 -41.61 86.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.163 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -59.14 -39.06 81.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.864 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 712' ' ' THR . . . . . 0.413 ' HA ' ' CG ' ' A' ' 715' ' ' GLU . 21.2 p -74.09 -40.38 62.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.123 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -66.17 -26.37 67.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.868 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -91.79 -49.19 6.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.094 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 715' ' ' GLU . . . . . 0.413 ' CG ' ' HA ' ' A' ' 712' ' ' THR . 2.2 pp20? -54.27 -34.72 61.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.891 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 716' ' ' GLU . . . . . 0.453 ' CD ' ' O ' ' A' ' 716' ' ' GLU . 0.1 OUTLIER -52.13 -17.96 1.28 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.91 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 717' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' A' ' 718' ' ' ARG . 8.4 tt0 -110.54 150.29 29.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.88 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 718' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 717' ' ' GLU . 9.5 mmp_? -34.5 -51.89 0.48 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.817 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 30.6 mtt180 -49.82 99.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.897 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 59.7 p -174.62 119.81 0.23 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -106.13 159.28 15.19 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.522 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.78 118.15 5.51 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.674 2.25 . . . . 0.0 112.38 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 723' ' ' SER . . . . . 0.418 ' O ' ' C ' ' A' ' 724' ' ' SER . 65.7 p -83.08 83.3 7.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.9 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 724' ' ' SER . . . . . 0.418 ' C ' ' O ' ' A' ' 723' ' ' SER . 6.8 t 37.04 42.86 0.27 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.827 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.523 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.45 -0.26 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 4.2 m 62.14 51.16 3.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.881 0.372 . . . . 0.0 110.859 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 66.8 m -84.75 140.99 30.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.882 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 171.14 109.6 0.23 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.466 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 50.0 m -113.88 -46.38 3.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.899 0.381 . . . . 0.0 110.865 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 51.4 p -169.21 176.5 5.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.834 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -167.27 125.99 1.38 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.455 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -39.11 130.12 1.59 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.761 0.315 . . . . 0.0 111.126 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -129.34 151.15 50.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.861 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -112.4 -59.62 1.98 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -108.18 158.31 17.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.854 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -83.43 80.1 9.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.094 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 656' ' ' ILE . . . . . 0.631 HG22 ' HD3' ' A' ' 658' ' ' PRO . 73.9 mt -120.18 109.5 26.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.14 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 85.0 t -110.33 82.06 2.55 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.559 0.695 . . . . 0.0 111.107 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.631 ' HD3' HG22 ' A' ' 656' ' ' ILE . 53.9 Cg_endo -69.82 167.52 24.28 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.684 2.256 . . . . 0.0 112.36 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.5 HD12 ' HE ' ' A' ' 662' ' ' ARG . 14.5 tp -51.91 -54.84 24.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.899 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -53.71 -35.86 61.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.402 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -64.0 -70.94 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.125 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.5 ' HE ' HD12 ' A' ' 659' ' ' LEU . 14.7 ptt180 -50.8 -48.14 59.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.831 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.652 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.5 mtt -54.05 -42.73 69.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.873 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -58.85 -47.4 84.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.902 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -55.42 -52.12 64.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.747 ' HB2' HD12 ' A' ' 697' ' ' LEU . 25.1 t80 -54.46 -57.44 11.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.849 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.568 ' HA ' HD12 ' A' ' 670' ' ' LEU . 16.9 ttmt -54.63 -35.98 64.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.968 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -60.1 -52.85 63.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.531 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 2.7 ptt? -65.14 -36.58 84.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.901 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 667' ' ' LYS . 32.0 mt -54.23 -49.35 69.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.889 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 31.2 tp -74.01 -52.02 14.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 672' ' ' GLU . . . . . 0.435 ' O ' ' N ' ' A' ' 674' ' ' GLY . 19.0 mt-10 -55.09 -65.77 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 673' ' ' ARG . . . . . 0.415 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 16.1 mmp_? -39.49 -28.54 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.838 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 674' ' ' GLY . . . . . 0.435 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 93.99 42.85 3.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.511 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.454 HG21 HD23 ' A' ' 670' ' ' LEU . 53.0 t -71.43 94.6 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.874 0.368 . . . . 0.0 111.131 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 57.7 m -58.83 125.41 23.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.85 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -64.72 -32.2 73.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.088 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -83.81 34.72 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.919 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.3 t -125.9 -175.03 3.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.897 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 680' ' ' THR . . . . . 0.654 HG23 ' H ' ' A' ' 683' ' ' LYS . 12.9 t -106.17 158.76 16.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.13 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 50.1 t-105 -63.28 -38.07 89.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.887 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -54.28 -57.13 12.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.911 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.654 ' H ' HG23 ' A' ' 680' ' ' THR . 5.9 mtpm? -60.64 -59.62 5.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.905 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -52.55 -34.69 51.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 8.3 tp -59.11 -62.1 2.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.913 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.73 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.5 p-80 -50.58 -35.06 28.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.848 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.584 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 44.0 mttp -63.87 -40.03 95.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.911 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 12.0 pt -105.22 13.9 7.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.137 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.73 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.1 p -79.81 -24.32 12.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.161 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 12.2 p90 -75.42 -44.35 44.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.852 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.471 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 7.3 t70 -53.13 139.42 45.08 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.619 0.723 . . . . 0.0 110.832 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.412 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.2 Cg_endo -69.77 -34.77 13.87 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.715 2.277 . . . . 0.0 112.345 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.527 ' HA ' HD12 ' A' ' 696' ' ' LEU . 36.6 mtm180 -58.41 -17.45 20.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.896 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 694' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -66.61 -15.55 63.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.892 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 27.8 mt -103.65 -12.31 17.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.926 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 693' ' ' ARG . 64.7 mt -62.42 -52.76 62.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.747 HD12 ' HB2' ' A' ' 666' ' ' PHE . 30.6 mt -84.67 148.05 26.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -56.22 162.47 3.03 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.634 0.73 . . . . 0.0 110.91 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 699' ' ' PRO . . . . . 0.555 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.8 Cg_endo -69.7 -32.12 19.43 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.731 2.287 . . . . 0.0 112.352 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 44.1 mttt -72.29 -46.81 54.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.899 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -60.34 -51.76 68.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.92 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.555 HH21 ' N ' ' A' ' 699' ' ' PRO . 44.6 mtm180 -39.27 -45.38 1.39 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.9 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -70.91 -43.49 68.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.907 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -60.89 -59.54 5.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.94 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.8 t -54.65 -41.45 55.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.114 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.566 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 5.3 t80 -60.18 -48.33 82.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -54.02 -47.29 71.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.803 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -65.95 -41.26 91.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.892 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.527 ' CZ ' ' HG3' ' A' ' 713' ' ' ARG . 12.6 t80 -61.82 -47.9 83.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.892 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.566 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 92.9 t -59.46 -43.99 91.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.1 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -57.31 -49.2 76.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.915 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 13.8 p -64.63 -41.46 96.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.128 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.527 ' HG3' ' CZ ' ' A' ' 709' ' ' TYR . 3.4 mmp_? -64.63 -36.62 84.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.888 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -74.46 -51.01 16.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.113 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -56.44 -41.89 77.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.866 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -84.56 28.54 0.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.846 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -129.41 139.59 51.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.906 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -84.12 156.71 22.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.878 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 6.3 tpp85 -119.4 134.92 54.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.884 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 1.2 t -48.03 158.75 0.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.855 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -49.79 144.37 9.69 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.49 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 176.15 7.14 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.674 2.25 . . . . 0.0 112.338 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 87.2 p -173.73 171.65 3.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.886 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 23.1 t -84.51 92.77 8.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.868 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.481 -179.996 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 48.3 t -91.45 159.54 15.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.858 0.361 . . . . 0.0 110.859 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 42.1 t -119.62 -47.94 2.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.892 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 149.79 127.11 1.49 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.508 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 49.9 m -134.22 122.63 23.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.895 0.378 . . . . 0.0 110.826 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 35.2 p -90.51 -60.89 1.8 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.889 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 66.06 81.88 0.13 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.512 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -106.05 101.98 11.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.782 0.325 . . . . 0.0 111.092 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 46.8 ttm-85 -132.73 106.05 7.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.872 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -90.39 41.01 1.03 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -126.96 151.03 49.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.911 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -101.75 34.7 2.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.103 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 68.7 mt -102.49 103.32 14.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.166 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 92.9 t -103.0 124.59 38.0 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.627 0.727 . . . . 0.0 111.097 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.529 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo -69.77 163.21 39.12 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.68 2.253 . . . . 0.0 112.347 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.444 HD12 ' HE ' ' A' ' 662' ' ' ARG . 10.4 tp -58.47 -48.62 80.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -55.36 -37.51 67.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.529 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -63.76 -66.1 0.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.124 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.802 ' HG3' HD21 ' A' ' 697' ' ' LEU . 11.2 ptt180 -51.5 -48.22 62.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.915 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.646 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.0 mtt -56.08 -47.58 77.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.906 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -52.59 -45.62 66.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.912 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -58.28 -62.35 1.9 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.926 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.49 ' CE2' HD11 ' A' ' 670' ' ' LEU . 22.9 t80 -45.1 -55.61 5.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.892 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -54.74 -48.11 72.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.882 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -47.84 -41.58 24.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.405 ' O ' ' C ' ' A' ' 670' ' ' LEU . 5.5 mtm -67.53 -63.96 0.95 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.883 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.49 HD11 ' CE2' ' A' ' 666' ' ' PHE . 44.6 mt -38.01 -34.85 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.916 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 15.9 tp -83.25 -56.03 4.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -54.71 -64.32 0.87 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.904 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 673' ' ' ARG . . . . . 0.405 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 2.5 mmp_? -44.38 -29.68 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.897 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 90.29 33.22 8.88 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.473 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.798 HG13 ' CD ' ' A' ' 684' ' ' GLU . 43.1 t -56.9 116.29 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 0.0 111.135 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 58.1 m -75.3 144.92 42.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.888 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 677' ' ' ALA . . . . . 0.425 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -82.68 -28.98 30.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.076 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -77.33 -2.06 33.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.853 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.2 m -90.57 -177.84 5.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.862 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 65.8 p -104.46 160.88 14.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.183 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.62 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 29.7 t-105 -64.75 -27.08 68.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.882 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -61.47 -58.83 6.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.868 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.44 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 17.0 mttm -55.73 -58.98 5.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.91 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.798 ' CD ' HG13 ' A' ' 675' ' ' VAL . 38.1 mm-40 -56.19 -44.85 79.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.869 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.62 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 6.4 tp -46.55 -62.26 1.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.929 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.493 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.5 p-80 -58.63 -30.62 67.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.868 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 43.5 mttm -69.34 -20.99 63.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 30.0 pt -122.68 8.31 5.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.189 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.493 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -77.7 -29.0 15.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.156 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.462 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 12.0 p90 -70.56 -44.43 67.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.915 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.462 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.6 t70 -53.22 139.76 45.19 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.573 0.702 . . . . 0.0 110.911 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.3 Cg_endo -69.67 -34.29 15.19 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.713 2.275 . . . . 0.0 112.369 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.588 ' HA ' HD12 ' A' ' 696' ' ' LEU . 16.5 mtm-85 -56.63 -24.39 47.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.874 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.45 ' CZ ' ' HD2' ' A' ' 702' ' ' ARG . 22.0 t80 -65.92 -17.88 64.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.888 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 15.8 mt -107.19 23.13 14.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 693' ' ' ARG . 78.5 mt -104.22 -29.5 10.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.89 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.802 HD21 ' HG3' ' A' ' 662' ' ' ARG . 26.7 mt -102.84 151.22 22.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.897 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 23.4 m-20 -50.74 161.85 0.62 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.635 0.731 . . . . 0.0 110.892 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 699' ' ' PRO . . . . . 0.403 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 54.1 Cg_endo -69.74 -37.1 9.69 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.725 2.283 . . . . 0.0 112.347 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -72.19 -39.28 68.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.916 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.451 ' O ' ' C ' ' A' ' 702' ' ' ARG . 35.7 mm-40 -59.88 -53.94 51.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.904 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.451 ' C ' ' O ' ' A' ' 701' ' ' GLU . 29.0 mtm105 -34.1 -48.03 0.3 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.914 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 16.5 tptt -72.35 -43.74 63.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.953 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 704' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' A' ' 701' ' ' GLU . 29.1 mt-30 -57.28 -56.92 15.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.908 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.72 -48.59 88.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.148 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.633 ' O ' HG23 ' A' ' 710' ' ' VAL . 52.7 t80 -57.2 -36.73 71.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.863 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -64.87 -51.5 61.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.864 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 708' ' ' GLN . . . . . 0.48 ' O ' HG23 ' A' ' 712' ' ' THR . 87.8 mm-40 -58.2 -36.34 72.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -67.18 -41.48 85.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.974 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 706' ' ' PHE . 96.7 t -69.42 -39.3 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.151 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 17.1 tttm -62.99 -40.58 98.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 712' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 708' ' ' GLN . 73.0 p -75.13 -38.59 61.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.13 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 5.8 mmm180 -60.23 -36.29 77.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 714' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' A' ' 717' ' ' GLU . . . -83.93 -58.88 2.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.111 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -47.9 -26.53 1.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.922 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -94.61 26.41 3.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.886 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 717' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 714' ' ' ALA . 3.4 tm-20 -54.83 91.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.916 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 19.2 ptt180 -84.92 161.93 19.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.885 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 13.5 ttm180 -43.12 152.46 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.874 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 23.3 m -47.78 128.48 13.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.812 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 165.4 76.09 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.455 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 157.94 58.7 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.703 2.268 . . . . 0.0 112.359 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 9.8 t -128.18 118.78 23.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.901 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 724' ' ' SER . . . . . 0.448 ' O ' ' C ' ' A' ' 725' ' ' GLY . 83.3 p -55.33 -44.57 75.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.851 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 725' ' ' GLY . . . . . 0.448 ' C ' ' O ' ' A' ' 724' ' ' SER . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.496 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.384 0 N-CA-C 112.506 -0.237 . . . . 0.0 112.506 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 1.1 t -127.93 102.73 6.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.892 0.377 . . . . 0.0 110.822 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 16.7 p -72.66 -15.6 61.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.853 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 62.92 108.62 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.472 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 3.4 m -112.2 86.03 2.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.865 0.364 . . . . 0.0 110.851 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 2.3 m -153.61 172.42 17.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 142.46 82.02 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.481 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -101.83 116.62 33.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.787 0.327 . . . . 0.0 111.071 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -105.33 124.52 49.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.882 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -79.41 -65.81 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.913 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 9.5 mmp_? -96.83 -179.14 4.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.882 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -95.75 53.29 1.41 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.089 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 27.5 mt -123.7 88.32 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.106 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 657' ' ' VAL . . . . . 0.63 ' CG2' ' HB3' ' A' ' 661' ' ' ALA . 4.3 p -74.96 130.39 81.08 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.574 0.702 . . . . 0.0 111.145 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.529 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.1 Cg_endo -69.81 154.98 66.92 Favored 'Trans proline' 0 C--O 1.232 0.222 0 C-N-CA 122.663 2.242 . . . . 0.0 112.289 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.425 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 15.2 tp -49.93 -49.74 48.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.87 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -54.35 -41.16 68.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.918 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.63 ' HB3' ' CG2' ' A' ' 657' ' ' VAL . . . -62.31 -70.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.091 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.644 ' HG3' HD21 ' A' ' 697' ' ' LEU . 7.6 ptt180 -48.46 -46.76 38.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.878 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.3 mtt -57.5 -46.53 83.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.846 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 3.7 mmmm -53.43 -45.83 69.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.887 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -58.16 -60.91 3.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.897 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.639 ' HB2' HD12 ' A' ' 697' ' ' LEU . 18.0 t80 -48.72 -58.74 4.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.922 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.698 ' HA ' HD12 ' A' ' 670' ' ' LEU . 51.5 tttt -51.84 -37.45 52.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.919 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -58.71 -54.18 49.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.896 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.531 ' CE ' ' CE1' ' A' ' 666' ' ' PHE . 2.7 ptt? -65.42 -37.07 85.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.908 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.698 HD12 ' HA ' ' A' ' 667' ' ' LYS . 30.0 mt -52.0 -50.62 60.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 37.7 tp -74.74 -47.36 31.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -56.74 -66.08 0.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.906 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -42.64 -25.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.853 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 85.98 44.34 6.04 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.479 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.558 HG13 ' CG ' ' A' ' 684' ' ' GLU . 25.8 t -68.37 109.62 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.784 0.326 . . . . 0.0 111.1 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 24.5 m -67.51 136.45 54.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.831 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 677' ' ' ALA . . . . . 0.673 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -69.58 -55.74 9.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.125 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -54.27 -30.81 51.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.852 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.9 m -55.83 167.14 0.61 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.863 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 44.8 p -93.88 153.45 18.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.154 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 33.9 t-105 -57.47 -26.1 60.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.933 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.25 -60.24 3.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.881 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -54.03 -59.07 5.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.87 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.558 ' CG ' HG13 ' A' ' 675' ' ' VAL . 59.6 mm-40 -54.39 -43.98 71.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 7.0 tp -48.23 -57.63 5.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.605 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.5 p-80 -59.29 -33.74 71.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.839 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.475 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 24.5 mttp -65.29 -26.08 67.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 16.4 pt -117.29 7.87 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.153 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.605 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -76.88 -35.91 24.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.11 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.451 ' CE1' ' O ' ' A' ' 687' ' ' LYS . 47.9 p90 -83.41 13.84 4.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 693' ' ' ARG . 2.9 t70 -102.46 143.61 26.95 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.614 0.721 . . . . 0.0 110.843 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.409 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.74 -46.81 1.1 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.688 2.259 . . . . 0.0 112.332 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.514 ' HA ' HD12 ' A' ' 696' ' ' LEU . 54.8 mtm180 -53.96 -26.06 23.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.607 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 0.7 OUTLIER -66.48 -27.92 68.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.938 -179.858 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.9 mt -89.0 2.85 53.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.964 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 693' ' ' ARG . 94.8 mt -86.98 -42.22 13.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.912 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.644 HD21 ' HG3' ' A' ' 662' ' ' ARG . 29.7 mt -91.17 144.46 25.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.891 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -51.41 161.85 0.75 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.58 0.705 . . . . 0.0 110.923 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -35.1 13.31 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.682 2.255 . . . . 0.0 112.34 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -72.09 -45.95 58.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -59.38 -45.55 91.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.839 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.607 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 42.0 mtt180 -43.45 -45.14 6.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.822 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.11 -44.68 62.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.875 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -57.6 -60.0 4.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.93 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 72.2 t -55.21 -47.12 77.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.159 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.577 ' O ' HG23 ' A' ' 710' ' ' VAL . 37.2 t80 -56.59 -41.25 76.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.897 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -59.12 -49.54 77.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.848 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -62.04 -42.63 99.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.93 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.586 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 7.0 t80 -58.75 -37.67 76.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.958 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.673 HG13 ' HB1' ' A' ' 677' ' ' ALA . 96.8 t -69.88 -45.89 75.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.162 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 26.9 tttm -51.95 -51.94 53.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.903 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 3.9 p -68.81 -31.1 69.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.175 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.586 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 3.2 mmm180 -65.96 -33.76 76.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.924 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -82.32 -46.84 13.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.138 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 715' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 717' ' ' GLU . 4.5 pt-20 -54.88 -43.18 72.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.941 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 716' ' ' GLU . . . . . 0.417 ' N ' ' CG ' ' A' ' 715' ' ' GLU . 16.4 tm-20 -39.67 -26.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.923 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 717' ' ' GLU . . . . . 0.466 ' N ' ' O ' ' A' ' 715' ' ' GLU . 0.0 OUTLIER -67.57 106.14 2.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.889 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 718' ' ' ARG . . . . . 0.441 ' C ' ' O ' ' A' ' 717' ' ' GLU . 8.7 ttt180 -34.35 143.48 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -120.79 142.64 49.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 28.7 t -46.04 101.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 167.67 151.94 7.25 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.499 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -11.59 31.19 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.691 2.261 . . . . 0.0 112.33 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 57.9 m -38.67 130.34 1.4 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.831 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 22.5 t -144.82 158.27 43.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.845 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.475 179.999 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.514 -0.234 . . . . 0.0 112.514 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 46.0 m -101.29 42.06 1.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.898 0.38 . . . . 0.0 110.858 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 4.4 t -101.64 -56.52 2.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.832 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 113.59 95.06 2.12 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.5 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 4.5 m -96.18 98.79 10.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.87 0.367 . . . . 0.0 110.861 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 40.5 t -164.29 139.45 5.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.841 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 155.74 102.36 0.2 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.49 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -93.41 99.75 12.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.785 0.326 . . . . 0.0 111.098 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 8.3 ptt-85 -75.07 136.03 41.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.869 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 653' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 654' ' ' ARG . 16.4 pt-20 -121.78 -47.53 2.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.874 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 654' ' ' ARG . . . . . 0.409 ' N ' ' HG3' ' A' ' 653' ' ' GLU . 23.9 mmt180 -97.45 161.26 13.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.858 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -87.34 80.87 8.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.074 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 65.9 mt -138.11 115.56 12.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.094 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 657' ' ' VAL . . . . . 0.422 ' HA ' ' HD2' ' A' ' 658' ' ' PRO . 88.1 t -101.49 98.1 8.74 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.604 0.716 . . . . 0.0 111.146 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.539 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.3 Cg_endo -69.78 152.24 69.17 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.664 2.243 . . . . 0.0 112.352 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.429 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 13.2 tp -49.25 -44.51 43.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -58.95 -42.26 89.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.539 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -61.0 -65.06 0.75 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.065 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.475 ' HG3' HD21 ' A' ' 697' ' ' LEU . 10.3 ptt180 -53.18 -54.33 37.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.904 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.521 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.7 mtt -51.47 -46.06 62.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.846 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.4 -43.4 71.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -59.55 -58.76 7.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.894 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.685 ' HB2' HD12 ' A' ' 697' ' ' LEU . 26.9 t80 -50.64 -51.31 50.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.89 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.434 ' HA ' HD12 ' A' ' 670' ' ' LEU . 27.4 tttt -60.89 -35.35 76.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.927 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -61.8 -56.61 17.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -59.87 -36.24 76.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.887 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.564 HD11 ' CE2' ' A' ' 666' ' ' PHE . 34.6 mt -56.95 -48.59 77.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.906 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.77 -45.23 62.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 672' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' A' ' 674' ' ' GLY . 23.2 mt-10 -61.67 -65.81 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -41.5 -24.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 674' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 86.71 46.86 5.02 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.452 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.44 HG13 ' CG ' ' A' ' 684' ' ' GLU . 24.4 t -72.22 106.4 2.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.829 0.347 . . . . 0.0 111.13 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 9.3 t -65.59 140.02 58.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.866 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 677' ' ' ALA . . . . . 0.4 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -78.75 -44.07 24.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.072 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -63.78 -20.89 66.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.4 m -69.04 -175.52 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.868 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 680' ' ' THR . . . . . 0.404 HG23 ' H ' ' A' ' 683' ' ' LYS . 12.5 t -106.61 167.24 9.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.136 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.498 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 31.4 t-105 -69.13 -26.8 65.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.866 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -61.2 -63.01 1.43 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.875 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.404 ' H ' HG23 ' A' ' 680' ' ' THR . 5.9 mtpm? -52.67 -59.03 4.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.44 ' CG ' HG13 ' A' ' 675' ' ' VAL . 49.1 mm-40 -55.51 -44.54 76.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.498 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.3 tp -47.79 -55.99 8.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.914 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.55 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.8 p-80 -61.9 -31.82 72.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.469 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 82.5 mttt -66.66 -24.91 66.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.918 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 20.9 pt -120.68 9.01 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.103 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.55 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.0 p -75.22 -26.69 18.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.175 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -84.65 -39.05 19.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.877 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.423 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 8.6 t70 -43.59 139.78 2.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.655 0.741 . . . . 0.0 110.867 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.82 -36.28 10.94 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.638 2.225 . . . . 0.0 112.357 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.644 ' HA ' HD12 ' A' ' 696' ' ' LEU . 57.0 mtm180 -65.16 -20.07 66.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.856 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.59 ' CE2' ' HD2' ' A' ' 702' ' ' ARG . 0.6 OUTLIER -66.03 -21.29 66.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.926 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 52.1 mt -93.89 -13.76 26.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.905 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.644 HD12 ' HA ' ' A' ' 693' ' ' ARG . 63.7 mt -67.47 -52.05 43.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.685 HD12 ' HB2' ' A' ' 666' ' ' PHE . 33.3 mt -79.72 147.23 32.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.91 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -51.51 162.54 0.69 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.627 0.727 . . . . 0.0 110.89 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 699' ' ' PRO . . . . . 0.402 ' HA ' ' CZ ' ' A' ' 702' ' ' ARG . 53.5 Cg_endo -69.75 -36.61 10.51 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.683 2.255 . . . . 0.0 112.335 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -72.19 -41.68 66.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 15.7 mt-10 -58.68 -51.22 70.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.59 ' HD2' ' CE2' ' A' ' 694' ' ' TYR . 24.7 mtm105 -34.23 -50.88 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.849 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -70.56 -46.2 63.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -55.47 -61.16 2.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.926 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 65.9 t -54.06 -45.19 65.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.086 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.68 -52.42 63.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.866 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -51.13 -47.19 62.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -63.4 -39.82 95.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.57 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 20.3 t80 -63.69 -49.63 72.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.921 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.4 HG13 ' HB1' ' A' ' 677' ' ' ALA . 82.4 t -55.93 -42.49 71.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.128 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -60.3 -46.17 90.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.899 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 15.8 p -65.8 -37.33 86.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.119 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.57 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.3 mmm180 -67.04 -28.73 68.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -83.18 -46.91 12.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.104 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -57.94 -38.45 75.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.91 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -90.1 29.77 1.18 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -47.89 112.78 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.897 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -42.45 -51.54 4.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -74.34 86.33 1.98 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.882 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 60.6 p -150.03 154.81 38.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.854 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -67.27 -77.45 0.31 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.481 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 120.85 7.56 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.662 2.242 . . . . 0.0 112.299 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 3.1 m -91.03 144.01 26.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 47.1 t -157.73 136.54 11.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.81 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.468 -179.995 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 16.0 t -102.05 102.86 13.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.93 0.395 . . . . 0.0 110.82 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 18.2 m -68.47 113.89 6.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.843 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 69.09 125.79 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.498 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 62.8 p -91.48 -43.82 9.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.864 0.364 . . . . 0.0 110.836 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 83.6 p -159.08 144.41 16.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.839 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -117.85 96.99 0.71 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.423 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -80.16 167.74 19.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.746 0.307 . . . . 0.0 111.132 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 9.7 mmp_? -111.5 43.36 1.52 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.891 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -131.77 168.84 17.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -119.31 -57.57 1.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.856 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -98.5 41.6 1.13 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.1 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 48.6 mm -126.41 81.94 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.143 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 657' ' ' VAL . . . . . 0.412 ' H ' HG13 ' A' ' 657' ' ' VAL . 2.2 m -49.63 149.95 3.94 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.604 0.716 . . . . 0.0 111.128 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.556 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.9 Cg_endo -69.75 162.35 42.4 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.674 2.249 . . . . 0.0 112.34 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 31.4 tp -54.69 -51.11 66.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.933 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 660' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 12.0 mm-40 -55.64 -30.5 61.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.92 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.556 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -71.84 -70.99 0.3 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.126 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.75 ' CZ ' HD23 ' A' ' 697' ' ' LEU . 0.1 OUTLIER -48.35 -52.69 20.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.897 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.606 ' HA ' HD11 ' A' ' 697' ' ' LEU . 6.0 mtt -54.84 -48.48 72.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 664' ' ' LYS . . . . . 0.467 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 1.7 mmmm -53.16 -37.45 61.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.916 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -64.01 -56.42 15.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.906 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.65 ' HB2' HD12 ' A' ' 697' ' ' LEU . 29.4 t80 -52.31 -47.61 65.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.504 ' HA ' HD12 ' A' ' 670' ' ' LEU . 41.3 tttt -67.26 -34.26 77.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.92 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -62.99 -44.76 95.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.877 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.431 ' O ' ' CG ' ' A' ' 673' ' ' ARG . 2.8 ptt? -70.35 -32.36 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 667' ' ' LYS . 40.8 mt -60.85 -49.82 75.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.892 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.5 tp -70.89 -55.91 7.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.942 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 672' ' ' GLU . . . . . 0.405 ' C ' ' N ' ' A' ' 674' ' ' GLY . 15.9 mt-10 -49.31 -63.58 1.06 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 673' ' ' ARG . . . . . 0.431 ' CG ' ' O ' ' A' ' 669' ' ' MET . 4.6 mmp_? -45.67 -21.31 0.11 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.843 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 674' ' ' GLY . . . . . 0.405 ' N ' ' C ' ' A' ' 672' ' ' GLU . . . 85.7 46.02 5.57 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.486 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.881 HG13 ' CD ' ' A' ' 684' ' ' GLU . 70.9 t -78.32 103.56 5.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 111.142 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 16.4 m -67.7 158.51 32.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.871 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 677' ' ' ALA . . . . . 0.445 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -88.57 -36.81 16.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.072 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -66.55 -10.08 41.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.919 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.1 m -82.7 175.49 10.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.822 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 59.4 p -102.44 178.33 4.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.172 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.462 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 50.6 t-105 -76.08 -25.22 55.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.933 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -67.15 -56.76 8.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.883 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.498 ' O ' ' CD2' ' A' ' 686' ' ' HIS . 59.6 mttm -53.94 -59.03 5.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.875 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.881 ' CD ' HG13 ' A' ' 675' ' ' VAL . 64.0 mm-40 -57.77 -45.8 85.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.462 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 7.9 tp -45.27 -53.38 8.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.921 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.645 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.7 p80 -68.41 -28.65 67.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.897 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.562 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 37.9 mttm -68.96 -21.12 64.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 26.1 pt -121.96 -0.38 7.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.115 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 686' ' ' HIS . 8.7 p -62.82 -25.32 38.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.13 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.562 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 18.6 p90 -93.59 11.66 28.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.835 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.429 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.5 t70 -99.3 139.85 21.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.596 0.712 . . . . 0.0 110.877 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.78 -31.78 19.78 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.688 2.259 . . . . 0.0 112.302 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 22.4 mtm-85 -67.21 -21.49 65.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.841 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.473 ' CD1' ' O ' ' A' ' 694' ' ' TYR . 10.6 t80 -68.55 -5.53 20.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.1 mt -120.91 14.8 11.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.944 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 55.5 mt -95.51 -26.18 15.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.939 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.75 HD23 ' CZ ' ' A' ' 662' ' ' ARG . 29.8 mt -112.12 155.56 23.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 698' ' ' ASN . . . . . 0.422 ' HB3' ' HD2' ' A' ' 699' ' ' PRO . 0.2 OUTLIER -54.47 158.52 4.02 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.603 0.716 . . . . 0.0 110.884 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 699' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 698' ' ' ASN . 53.2 Cg_endo -69.82 -33.73 15.77 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.626 2.217 . . . . 0.0 112.345 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -72.69 -46.01 55.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.945 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' A' ' 704' ' ' GLN . 0.4 OUTLIER -62.35 -54.52 39.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.877 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.528 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 57.0 mtm180 -34.21 -48.29 0.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.902 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.57 -41.34 69.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.901 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 704' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 701' ' ' GLU . 21.5 mm-40 -60.39 -56.63 19.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 33.2 t -57.31 -43.25 81.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.116 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.495 ' O ' HG23 ' A' ' 710' ' ' VAL . 21.8 t80 -62.17 -37.93 87.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.891 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -60.86 -49.86 75.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.863 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -61.44 -35.34 77.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.539 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 0.8 OUTLIER -65.65 -35.98 82.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.954 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 706' ' ' PHE . 93.5 t -70.95 -51.3 36.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.135 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 12.9 ttmt -56.8 -35.81 69.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.918 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 15.6 p -75.1 -39.78 60.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.184 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.539 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 2.4 mmp_? -64.32 -35.66 81.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.85 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -82.88 -55.19 4.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.112 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -52.57 -28.82 22.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.875 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -93.72 25.45 3.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.919 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -65.83 83.31 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.878 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -86.2 149.2 25.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.876 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -110.35 -62.36 1.53 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.916 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 4.2 m -94.09 168.91 10.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.891 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -65.04 146.24 50.05 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.497 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 134.51 28.13 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.706 2.271 . . . . 0.0 112.304 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 90.8 p -111.83 -12.99 13.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.866 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 45.5 m -123.88 151.19 43.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.852 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.499 179.995 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 5.7 t -88.06 133.88 33.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.893 0.378 . . . . 0.0 110.834 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 15.0 t -160.99 153.25 20.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.858 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 149.73 -52.85 0.52 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.513 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 53.7 p 46.31 41.23 8.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.87 0.367 . . . . 0.0 110.828 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 4.4 t 69.74 43.25 0.98 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.897 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -100.21 79.87 0.47 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.487 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -134.81 129.74 35.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.796 0.331 . . . . 0.0 111.097 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 39.6 mtp180 -60.8 -66.18 0.57 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 653' ' ' GLU . . . . . 0.503 ' OE2' ' CZ ' ' A' ' 654' ' ' ARG . 5.1 tp10 -100.51 174.53 6.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.931 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 654' ' ' ARG . . . . . 0.503 ' CZ ' ' OE2' ' A' ' 653' ' ' GLU . 0.0 OUTLIER -93.66 -14.53 26.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.896 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -130.67 22.05 5.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.101 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 63.1 mt -140.17 123.58 17.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.106 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 25.7 m -65.81 149.81 97.06 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.629 0.728 . . . . 0.0 111.164 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 158.45 56.92 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.724 2.283 . . . . 0.0 112.338 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.43 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 18.6 tp -48.05 -49.05 32.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -55.53 -41.13 72.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -61.47 -67.64 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.727 ' HG3' HD21 ' A' ' 697' ' ' LEU . 7.9 ptt180 -51.14 -46.4 61.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.869 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.58 ' HA ' HD11 ' A' ' 697' ' ' LEU . 6.7 mtt -58.83 -49.47 77.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.895 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 16.3 mtmt -49.62 -46.24 49.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 665' ' ' GLN . . . . . 0.471 ' OE1' ' CD1' ' A' ' 696' ' ' LEU . 86.4 mt-30 -59.33 -64.1 1.06 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.885 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.736 ' HB2' HD12 ' A' ' 697' ' ' LEU . 27.6 t80 -41.52 -56.95 2.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.88 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 35.1 tttp -54.94 -47.41 74.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -50.59 -33.17 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.854 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.423 ' O ' ' C ' ' A' ' 670' ' ' LEU . 5.4 mtm -74.58 -65.79 0.82 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' A' ' 669' ' ' MET . 83.6 mt -35.3 -40.91 0.15 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.89 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.9 tp -76.67 -58.15 3.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.934 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 672' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 674' ' ' GLY . 8.3 mm-40 -57.78 -64.3 0.95 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 673' ' ' ARG . . . . . 0.434 ' C ' ' O ' ' A' ' 672' ' ' GLU . 4.2 mmp_? -35.02 -34.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.873 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 674' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 98.03 42.27 3.09 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.419 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.631 HG13 ' HG3' ' A' ' 684' ' ' GLU . 94.9 t -75.56 136.94 23.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.844 0.354 . . . . 0.0 111.156 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 15.9 m -103.7 121.89 43.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.841 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 677' ' ' ALA . . . . . 0.526 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -45.98 -57.88 4.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.121 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -46.46 -30.24 2.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.902 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.87 160.72 11.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.854 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 680' ' ' THR . . . . . 0.517 HG23 ' H ' ' A' ' 683' ' ' LYS . 14.4 t -82.33 -177.74 6.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.146 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.558 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 19.3 t-105 -84.3 -34.52 23.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.938 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -64.32 -59.86 3.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.517 ' H ' HG23 ' A' ' 680' ' ' THR . 12.4 mtpt -46.25 -58.94 3.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.915 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.631 ' HG3' HG13 ' A' ' 675' ' ' VAL . 31.9 mm-40 -62.64 -47.58 83.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.852 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.558 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 7.3 tp -43.16 -48.54 6.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.92 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.693 ' O ' HG12 ' A' ' 689' ' ' VAL . 0.9 OUTLIER -70.42 -38.43 74.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.85 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.517 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 44.3 mttp -60.56 -19.56 57.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.835 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 19.5 pt -115.39 -16.78 8.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.147 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -55.26 -32.41 28.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.143 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -62.74 -36.41 82.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.861 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.425 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 8.5 t70 -64.0 139.74 97.73 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.609 0.719 . . . . 0.0 110.848 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.8 -36.92 9.82 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.708 2.272 . . . . 0.0 112.315 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.47 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 22.3 mtm-85 -56.39 -19.72 16.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.852 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.614 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 27.5 t80 -66.76 -18.5 65.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.894 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 20.1 mt -96.3 -3.85 43.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.471 ' CD1' ' OE1' ' A' ' 665' ' ' GLN . 83.0 mt -77.09 -43.72 33.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.911 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.736 HD12 ' HB2' ' A' ' 666' ' ' PHE . 31.9 mt -89.88 152.24 21.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.904 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 24.2 m-20 -61.84 162.1 18.56 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.663 0.744 . . . . 0.0 110.849 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 699' ' ' PRO . . . . . 0.422 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.4 Cg_endo -69.7 -34.06 15.57 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.694 2.262 . . . . 0.0 112.364 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 29.3 mttm -72.13 -47.07 53.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 24.4 mt-10 -60.75 -56.53 20.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.903 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.614 ' NH1' ' CE2' ' A' ' 694' ' ' TYR . 46.0 mtm180 -34.59 -45.41 0.24 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.849 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.34 -45.76 62.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 704' ' ' GLN . . . . . 0.435 ' N ' ' O ' ' A' ' 701' ' ' GLU . 11.2 mm100 -57.12 -50.35 73.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.914 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.64 -39.24 83.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.11 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.831 ' O ' HG23 ' A' ' 710' ' ' VAL . 24.4 t80 -65.22 -36.84 85.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.859 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -64.68 -52.39 57.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.88 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 708' ' ' GLN . . . . . 0.466 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 5.5 pt20 -60.67 -36.65 79.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.913 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.488 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 11.7 t80 -66.76 -39.5 87.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.924 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 706' ' ' PHE . 99.6 t -64.55 -45.63 95.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.196 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 711' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 711' ' ' LYS . 0.9 OUTLIER -59.38 -52.22 66.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.9 179.867 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 18.4 p -60.16 -37.79 81.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.157 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.488 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 3.4 mmp_? -65.11 -38.28 90.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.902 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -74.12 -54.95 6.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.142 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -51.65 -39.32 57.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.868 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -87.55 30.35 0.81 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.16 99.49 9.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -104.39 -41.54 5.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.852 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -93.36 109.79 21.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.835 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 40.5 m -100.02 166.2 11.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -69.59 146.98 44.6 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.441 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 -37.62 8.87 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.679 2.253 . . . . 0.0 112.319 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 6.1 t -137.99 156.56 47.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.847 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 50.3 m -80.38 146.18 31.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.857 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.379 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.493 -179.981 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 6.6 t -104.0 166.33 10.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.881 0.372 . . . . 0.0 110.842 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 71.4 m -132.4 -49.39 0.92 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.896 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 140.37 168.04 11.23 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.473 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 81.1 p -150.07 164.94 34.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.886 0.374 . . . . 0.0 110.868 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 60.7 p -108.82 -42.96 4.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.837 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 76.75 123.16 0.2 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.469 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -112.34 87.21 2.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.75 0.309 . . . . 0.0 111.112 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 5.9 ptp85 -134.44 174.79 10.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.883 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -95.66 -58.28 2.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.894 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -117.11 134.62 54.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -66.64 96.07 0.37 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.077 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 4.4 mm -131.19 96.05 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.104 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 15.8 m -56.27 150.43 32.23 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.635 0.731 . . . . 0.0 111.135 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 160.66 48.89 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.629 2.219 . . . . 0.0 112.366 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 25.3 tp -51.14 -48.57 61.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.938 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 660' ' ' GLU . . . . . 0.485 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 14.1 pt-20 -56.03 -36.19 67.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.87 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.41 -71.07 0.22 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.148 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.454 ' HE ' HD23 ' A' ' 697' ' ' LEU . 3.3 ptm180 -46.53 -56.98 5.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.464 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.9 mtt -50.69 -49.8 56.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.902 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 664' ' ' LYS . . . . . 0.485 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 2.5 mmmm -51.74 -41.09 61.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.91 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -60.8 -56.46 20.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.883 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.635 ' HB2' HD12 ' A' ' 697' ' ' LEU . 24.8 t80 -51.73 -55.55 19.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.83 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -54.89 -35.86 64.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.928 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -60.14 -47.58 85.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.856 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.526 ' CE ' ' CE1' ' A' ' 666' ' ' PHE . 2.9 ptt? -72.75 -36.4 67.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.894 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.533 HD11 ' CE2' ' A' ' 666' ' ' PHE . 33.1 mt -52.42 -51.19 60.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.965 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 23.3 tp -76.96 -53.62 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.939 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -49.64 -61.44 2.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.874 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 15.6 mmp_? -49.42 -19.57 0.56 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 82.09 44.34 7.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.45 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.44 HG13 ' CG ' ' A' ' 684' ' ' GLU . 71.7 t -70.13 103.54 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.839 0.352 . . . . 0.0 111.136 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 19.4 t -63.0 145.54 55.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.824 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 677' ' ' ALA . . . . . 0.487 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -81.58 -36.85 28.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.1 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -72.75 -9.11 58.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.865 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.1 m -80.94 168.13 19.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.885 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 15.2 t -95.81 173.62 7.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.182 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.467 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 57.0 t-105 -70.64 -30.82 67.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.876 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -59.79 -59.16 5.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.574 ' HA ' ' CD2' ' A' ' 686' ' ' HIS . 38.5 mttm -56.78 -59.01 5.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.44 ' CG ' HG13 ' A' ' 675' ' ' VAL . 56.5 mm-40 -55.51 -39.27 70.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.872 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.467 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 8.0 tp -53.37 -59.6 4.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.868 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.713 ' O ' HG12 ' A' ' 689' ' ' VAL . 2.0 p80 -60.02 -27.6 67.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.879 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.556 ' HG3' ' CE1' ' A' ' 686' ' ' HIS . 47.6 mttm -69.25 -34.18 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.877 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 7.5 pt -111.26 9.66 8.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.125 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 686' ' ' HIS . 9.8 p -70.25 -32.71 51.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.117 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 5.2 p90 -77.1 -38.49 52.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.864 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.447 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 9.1 t70 -50.94 139.76 21.96 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.559 0.695 . . . . 0.0 110.887 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.2 Cg_endo -69.76 -37.82 8.64 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.693 2.262 . . . . 0.0 112.329 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.476 ' HA ' HD12 ' A' ' 696' ' ' LEU . 14.4 mtm-85 -58.87 -20.98 56.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.88 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.438 ' OH ' ' CD1' ' A' ' 685' ' ' LEU . 61.8 t80 -69.2 -7.76 39.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.912 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 33.2 mt -119.07 20.48 12.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.476 HD12 ' HA ' ' A' ' 693' ' ' ARG . 96.7 mt -104.57 -34.98 8.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.934 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.635 HD12 ' HB2' ' A' ' 666' ' ' PHE . 29.1 mt -101.55 144.34 30.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.92 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 20.1 m-20 -48.7 161.88 0.39 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.659 0.742 . . . . 0.0 110.842 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 699' ' ' PRO . . . . . 0.414 ' HA ' ' NE ' ' A' ' 702' ' ' ARG . 54.3 Cg_endo -69.7 -33.88 15.89 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.693 2.262 . . . . 0.0 112.358 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 3.9 mptt -72.15 -44.96 62.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.836 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.508 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -61.28 -50.74 71.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.895 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.414 ' NE ' ' HA ' ' A' ' 699' ' ' PRO . 53.8 mtm180 -39.97 -45.28 1.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 703' ' ' LYS . . . . . 0.403 ' HD2' ' C ' ' A' ' 703' ' ' LYS . 2.0 tmmm? -71.68 -43.89 65.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.857 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -58.62 -58.17 9.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.0 t -57.56 -40.66 76.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.107 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.893 ' O ' HG23 ' A' ' 710' ' ' VAL . 18.5 t80 -66.78 -30.66 70.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.922 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 707' ' ' ASP . . . . . 0.428 ' C ' ' OD1' ' A' ' 707' ' ' ASP . 0.8 OUTLIER -66.44 -55.28 16.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.864 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 708' ' ' GLN . . . . . 0.401 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 7.0 pt20 -57.9 -41.72 83.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.936 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.546 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 0.8 OUTLIER -60.2 -41.01 92.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.953 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 706' ' ' PHE . 92.8 t -63.56 -50.42 78.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.085 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -51.14 -51.62 51.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.907 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 2.3 p -60.18 -40.47 90.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.122 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.546 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 2.6 mmp_? -66.16 -26.96 67.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.842 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -80.15 -53.49 6.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.094 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -54.44 -39.67 67.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 716' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 717' ' ' GLU . 1.7 tp10 -83.99 20.63 1.49 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.877 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 717' ' ' GLU . . . . . 0.447 ' C ' ' O ' ' A' ' 716' ' ' GLU . 9.9 pt-20 -34.5 124.79 0.52 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.864 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.88 147.37 31.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 26.4 mtp180 -103.41 -66.18 0.96 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.855 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 44.0 t -124.71 163.1 22.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.879 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 168.23 159.79 14.61 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.489 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 141.23 44.91 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.718 2.278 . . . . 0.0 112.383 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 7.4 t -46.91 -57.02 5.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.884 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 27.0 m -109.28 131.52 54.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.882 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.491 -179.929 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 112.501 -0.239 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 99.4 p -156.23 165.4 36.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.927 0.394 . . . . 0.0 110.869 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 7.7 t -139.28 168.57 19.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.864 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . -178.71 80.67 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.483 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 2.9 t -132.06 87.37 2.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.863 0.363 . . . . 0.0 110.886 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 29.0 p -64.54 175.88 1.27 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.867 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 64.07 130.99 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.514 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -139.26 170.69 15.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.77 0.319 . . . . 0.0 111.116 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -100.92 145.83 28.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.913 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -52.7 -17.07 1.14 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.874 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -72.45 140.59 48.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.859 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -112.62 26.66 10.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.126 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 656' ' ' ILE . . . . . 0.449 ' N ' HD12 ' A' ' 656' ' ' ILE . 4.9 mp -103.01 93.7 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.144 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 10.5 m -53.99 145.71 32.2 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.578 0.704 . . . . 0.0 111.145 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.0 Cg_endo -69.74 163.67 37.38 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.703 2.269 . . . . 0.0 112.333 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 23.7 tp -56.19 -48.71 75.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 660' ' ' GLU . . . . . 0.462 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 29.3 mt-10 -56.05 -32.64 64.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.848 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.433 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -69.97 -69.98 0.32 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.135 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.616 ' HG3' HD21 ' A' ' 697' ' ' LEU . 5.6 ptm180 -45.56 -48.09 14.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.855 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.701 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.5 mtt -56.39 -54.02 50.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 664' ' ' LYS . . . . . 0.462 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 3.3 mmpt? -48.37 -46.49 36.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -55.62 -63.37 1.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.734 ' HB2' HD12 ' A' ' 697' ' ' LEU . 22.8 t80 -45.38 -52.43 9.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.922 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -58.35 -44.22 88.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.861 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -51.47 -39.75 58.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.829 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 16.3 mtm -68.73 -58.6 3.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 52.6 mt -43.11 -38.37 2.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.911 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 15.4 tp -80.41 -58.88 2.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -52.85 -64.36 0.84 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.904 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -46.3 -25.76 0.69 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.821 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 85.78 31.07 22.04 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.468 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.572 HG13 ' CD ' ' A' ' 684' ' ' GLU . 24.4 t -53.84 108.74 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.857 0.36 . . . . 0.0 111.142 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 8.3 t -64.55 149.71 48.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.87 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 677' ' ' ALA . . . . . 0.486 ' HA ' HG13 ' A' ' 710' ' ' VAL . . . -82.56 -39.82 21.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.118 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -66.53 -24.69 66.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.858 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.8 m -63.66 171.0 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.884 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 680' ' ' THR . . . . . 0.625 HG22 ' HE3' ' A' ' 683' ' ' LYS . 10.8 t -100.25 166.07 11.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 52.6 t-105 -63.53 -33.32 75.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.897 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -58.79 -56.11 26.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.88 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.625 ' HE3' HG22 ' A' ' 680' ' ' THR . 26.6 mtmt -57.7 -59.08 5.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.881 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.572 ' CD ' HG13 ' A' ' 675' ' ' VAL . 56.1 mm-40 -55.99 -37.67 69.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.894 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 18.0 tp -53.75 -58.79 5.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.667 ' O ' HG12 ' A' ' 689' ' ' VAL . 2.5 p-80 -59.4 -32.03 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.822 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.549 ' O ' ' CE2' ' A' ' 690' ' ' PHE . 40.9 mttm -66.17 -29.03 69.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.868 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 20.1 pt -114.75 8.16 7.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.141 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.667 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.0 p -75.37 -34.53 30.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.127 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.549 ' CE2' ' O ' ' A' ' 687' ' ' LYS . 51.3 p90 -81.85 12.67 3.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.896 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.426 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 11.2 t70 -101.23 139.9 20.83 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.581 0.705 . . . . 0.0 110.849 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.72 -40.07 5.82 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.676 2.251 . . . . 0.0 112.347 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.434 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 16.1 mtm-85 -61.43 -30.96 70.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.836 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.455 ' CE1' ' HD3' ' A' ' 702' ' ' ARG . 41.2 t80 -59.91 -12.93 8.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.911 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.413 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 28.4 mt -108.58 19.76 19.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.911 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.434 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 97.6 mt -101.73 -48.59 4.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.876 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.734 HD12 ' HB2' ' A' ' 666' ' ' PHE . 29.0 mt -82.71 146.84 28.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.902 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -49.95 161.65 0.54 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.642 0.734 . . . . 0.0 110.92 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -34.31 14.96 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.723 2.282 . . . . 0.0 112.356 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -72.09 -45.23 61.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.897 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 702' ' ' ARG . 67.7 mm-40 -58.6 -50.77 72.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.9 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.455 ' HD3' ' CE1' ' A' ' 694' ' ' TYR . 68.7 mtt180 -35.82 -49.24 0.6 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.892 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 10.8 tptp -71.76 -44.83 63.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.854 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -57.46 -62.25 1.91 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.929 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 66.7 t -53.77 -48.43 61.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.17 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.672 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 23.8 t80 -61.07 -37.46 82.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -57.27 -50.86 71.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.919 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -61.38 -40.5 94.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.566 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 4.2 t80 -63.52 -40.93 98.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.908 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.672 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 85.4 t -67.03 -53.61 32.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.153 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 13.6 mtpp -48.69 -53.55 18.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.852 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 1.1 p -61.27 -41.44 96.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.119 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.566 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 12.7 mmm180 -64.23 -25.79 68.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.869 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -78.95 -44.41 22.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.09 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -67.5 -33.4 75.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 716' ' ' GLU . . . . . 0.432 ' O ' ' C ' ' A' ' 717' ' ' GLU . 3.7 tt0 -86.08 19.61 2.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.914 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 717' ' ' GLU . . . . . 0.432 ' C ' ' O ' ' A' ' 716' ' ' GLU . 9.8 pt-20 -36.21 133.62 0.47 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.86 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 22.7 ptt180 -109.28 124.4 50.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.873 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -42.88 112.44 0.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.899 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 1.7 t -72.66 107.84 5.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.851 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -82.84 -68.43 1.43 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.496 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 722' ' ' PRO . . . . . 0.446 ' O ' ' C ' ' A' ' 723' ' ' SER . 53.4 Cg_endo -69.8 2.67 3.34 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.664 2.243 . . . . 0.0 112.329 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 723' ' ' SER . . . . . 0.446 ' C ' ' O ' ' A' ' 722' ' ' PRO . 3.9 p -34.66 124.18 0.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.852 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 23.4 p -129.33 178.93 6.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.881 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.38 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.498 179.999 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 8.1 t 56.29 45.72 22.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.885 0.374 . . . . 0.0 110.851 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 5.7 m -130.73 156.79 44.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.854 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 166.19 116.43 0.36 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.498 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 52.1 p -171.84 126.45 0.59 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.88 0.372 . . . . 0.0 110.861 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 80.3 p -164.06 166.79 21.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.871 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 114.01 135.06 6.0 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.501 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -134.57 89.43 2.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.791 0.329 . . . . 0.0 111.068 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -127.21 139.39 52.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -125.66 96.06 4.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.877 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 654' ' ' ARG . . . . . 0.69 ' HG2' HD12 ' A' ' 656' ' ' ILE . 21.7 tpp180 -115.87 145.69 42.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.873 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -84.18 34.8 0.52 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.068 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 656' ' ' ILE . . . . . 0.69 HD12 ' HG2' ' A' ' 654' ' ' ARG . 32.6 mt -121.41 113.84 40.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.136 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 57.6 t -113.77 122.2 35.47 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.625 0.726 . . . . 0.0 111.138 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.52 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo -69.77 146.56 60.49 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.635 2.223 . . . . 0.0 112.359 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 41.2 tp -49.26 -49.21 44.48 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.897 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -51.83 -39.69 59.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.878 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.52 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -66.59 -70.29 0.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.116 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -44.05 -43.34 6.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.875 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.623 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.6 mtt -65.29 -40.32 93.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.86 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 17.3 mmmt -59.55 -41.41 90.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -65.16 -63.6 1.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.936 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.738 ' HB2' HD12 ' A' ' 697' ' ' LEU . 25.8 t80 -39.94 -57.2 1.66 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.861 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -54.64 -48.35 72.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.924 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -49.98 -35.39 24.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.848 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.427 ' O ' ' N ' ' A' ' 672' ' ' GLU . 4.7 mtm -71.84 -65.32 0.78 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.454 HD11 ' CE2' ' A' ' 666' ' ' PHE . 49.7 mt -36.83 -38.94 0.19 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.912 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 12.6 tp -75.51 -44.68 42.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 672' ' ' GLU . . . . . 0.427 ' N ' ' O ' ' A' ' 669' ' ' MET . 11.5 mm-40 -72.87 -64.55 0.94 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.892 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 673' ' ' ARG . . . . . 0.429 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 12.5 mmp_? -39.16 -35.68 0.25 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.847 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 98.66 28.67 7.78 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.46 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.569 HG13 ' CG ' ' A' ' 684' ' ' GLU . 38.0 t -59.43 91.78 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.847 0.356 . . . . 0.0 111.135 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 73.7 m -49.11 151.16 1.4 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.821 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -84.69 -48.11 9.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.127 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -56.36 -31.26 63.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.865 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -60.28 -178.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.889 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 10.9 t -104.45 -177.3 3.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.146 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.492 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 45.9 t-105 -83.05 -29.5 28.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.891 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -60.88 -60.79 3.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.881 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -54.15 -58.99 5.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.948 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.569 ' CG ' HG13 ' A' ' 675' ' ' VAL . 23.9 mm-40 -56.44 -42.51 78.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.895 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.492 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 7.7 tp -48.49 -54.92 12.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.985 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.631 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.8 p-80 -63.67 -32.69 74.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 40.2 mttm -66.41 -23.22 66.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 22.4 pt -120.08 5.76 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.147 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.631 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.3 p -73.0 -25.24 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.117 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.577 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 13.1 p90 -76.25 -52.37 10.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.863 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.577 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.0 t70 -37.14 139.84 0.48 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.577 0.703 . . . . 0.0 110.862 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.5 Cg_endo -69.8 -36.49 10.61 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.631 2.22 . . . . 0.0 112.326 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.47 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 69.3 mtm180 -63.86 -19.44 65.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.53 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 27.7 t80 -66.07 -15.14 62.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.947 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 14.1 mt -101.47 3.71 40.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.897 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.47 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 80.3 mt -83.71 -49.58 8.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.885 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.738 HD12 ' HB2' ' A' ' 666' ' ' PHE . 30.7 mt -83.81 143.91 29.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -52.11 162.33 0.85 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.651 0.739 . . . . 0.0 110.873 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 699' ' ' PRO . . . . . 0.41 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.7 Cg_endo -69.79 -35.42 12.59 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.674 2.249 . . . . 0.0 112.349 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 35.5 mttm -72.16 -46.3 56.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.877 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -59.7 -51.2 70.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.541 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 47.3 mtm180 -40.09 -46.92 2.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.908 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -68.15 -45.89 72.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.884 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -58.04 -58.47 8.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 97.6 t -55.06 -37.47 42.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.121 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.682 ' O ' HG23 ' A' ' 710' ' ' VAL . 16.3 t80 -69.0 -32.13 71.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.844 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -68.58 -47.21 67.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.829 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 708' ' ' GLN . . . . . 0.403 ' HG2' ' N ' ' A' ' 709' ' ' TYR . 4.0 pt20 -68.17 -36.89 80.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.945 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.481 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 3.7 t80 -66.26 -41.02 90.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.931 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.682 HG23 ' O ' ' A' ' 706' ' ' PHE . 57.7 t -65.55 -45.51 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.138 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 6.8 ttmm -57.97 -51.24 70.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.903 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.7 p -61.39 -38.16 86.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.133 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.481 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 9.4 mmp_? -65.26 -33.65 76.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.888 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -77.34 -49.04 15.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.15 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 715' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' A' ' 716' ' ' GLU . 8.5 pt-20 -58.2 -44.44 88.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.865 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 716' ' ' GLU . . . . . 0.446 ' N ' ' CG ' ' A' ' 715' ' ' GLU . 5.1 mm-40 -84.51 27.49 0.71 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -104.94 96.9 6.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.901 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 718' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 719' ' ' ARG . 17.7 ptt180 -103.69 172.17 6.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.869 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 719' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 718' ' ' ARG . 0.1 OUTLIER -34.83 151.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.844 -179.916 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 70.5 p -170.24 173.58 5.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.872 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -116.09 -88.99 1.49 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.494 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 138.13 36.92 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.613 2.209 . . . . 0.0 112.345 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 40.9 t -165.06 144.64 6.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.879 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 67.6 p -172.28 174.56 3.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.818 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.486 -180.0 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.365 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 83.6 p -49.59 -45.55 48.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.888 0.375 . . . . 0.0 110.845 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 41.1 t -82.02 89.31 6.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.862 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . -161.73 66.92 0.25 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.549 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 19.3 m -151.17 133.31 15.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.894 0.378 . . . . 0.0 110.859 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 4.5 m -159.14 149.74 19.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.89 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -151.27 105.97 0.3 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.516 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -89.44 33.55 0.82 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.804 0.335 . . . . 0.0 111.111 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 30.8 mmm-85 -124.87 154.31 41.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.884 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 73.4 mt-10 -125.48 110.37 13.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.864 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 27.9 ttt85 -132.63 141.14 48.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.854 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -119.99 51.52 1.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.122 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 14.9 mm -134.89 89.23 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.14 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 657' ' ' VAL . . . . . 0.41 ' HA ' ' HD2' ' A' ' 658' ' ' PRO . 88.8 t -61.05 111.3 3.97 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.635 0.731 . . . . 0.0 111.123 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.514 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.5 Cg_endo -69.76 165.84 29.63 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.66 2.24 . . . . 0.0 112.317 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.412 HD12 ' HE ' ' A' ' 662' ' ' ARG . 13.8 tp -57.88 -53.43 58.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -51.84 -35.52 44.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.904 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.514 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -64.86 -68.01 0.39 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.114 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.785 ' HG3' HD21 ' A' ' 697' ' ' LEU . 14.3 ptt180 -52.12 -41.72 62.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.885 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.612 ' HA ' HD11 ' A' ' 697' ' ' LEU . 6.7 mtt -61.76 -43.27 99.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 664' ' ' LYS . . . . . 0.432 ' HA ' ' CE ' ' A' ' 664' ' ' LYS . 0.4 OUTLIER -58.44 -41.66 85.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.928 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 665' ' ' GLN . . . . . 0.568 ' OE1' HD13 ' A' ' 696' ' ' LEU . 81.5 mt-30 -61.23 -54.0 49.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.962 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.692 ' HB2' HD12 ' A' ' 697' ' ' LEU . 23.2 t80 -56.07 -45.19 79.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 6.0 ttpt -66.84 -36.47 82.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.919 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -60.33 -46.91 88.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.849 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.407 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 2.8 ptt? -69.2 -36.84 77.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.539 HD23 HG21 ' A' ' 675' ' ' VAL . 36.2 mt -56.4 -44.28 80.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.926 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 54.0 tp -76.34 -54.71 6.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.86 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.08 -61.9 1.95 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -48.07 -19.51 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.904 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 81.83 41.17 9.88 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.473 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.658 HG13 ' CG ' ' A' ' 684' ' ' GLU . 77.1 t -65.1 100.81 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.854 0.359 . . . . 0.0 111.151 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 58.2 m -52.22 148.07 6.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.873 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 677' ' ' ALA . . . . . 0.54 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -84.04 -39.34 19.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.126 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -82.69 43.91 0.87 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.8 m -130.86 -175.8 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.844 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 680' ' ' THR . . . . . 0.415 HG23 ' H ' ' A' ' 683' ' ' LYS . 3.3 t -109.72 162.74 14.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.12 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.495 ' CH2' ' HB3' ' A' ' 702' ' ' ARG . 35.1 t-105 -65.37 -27.31 68.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.941 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -59.44 -60.17 4.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.924 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.415 ' H ' HG23 ' A' ' 680' ' ' THR . 22.6 mtpt -55.23 -59.0 5.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.658 ' CG ' HG13 ' A' ' 675' ' ' VAL . 49.9 mm-40 -54.8 -41.9 71.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.868 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.1 tp -50.66 -55.22 17.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.841 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.1 p-80 -60.05 -35.03 74.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.844 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.544 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 22.2 mttp -67.53 -23.04 65.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.899 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 6.9 pt -116.73 6.47 7.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.072 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.841 HG12 ' O ' ' A' ' 686' ' ' HIS . 9.0 p -70.93 -24.69 24.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.111 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.527 ' C ' ' CD1' ' A' ' 690' ' ' PHE . 2.4 p90 -87.98 -13.25 42.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.885 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.431 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.6 t70 -77.4 139.87 64.33 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.643 0.735 . . . . 0.0 110.824 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.0 Cg_endo -69.76 -34.16 15.13 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.684 2.256 . . . . 0.0 112.336 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.548 ' HA ' HD12 ' A' ' 696' ' ' LEU . 82.0 mtm180 -65.83 -16.1 63.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.858 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.432 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 33.0 t80 -70.0 -7.69 42.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.918 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 15.1 mt -118.13 12.14 13.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.907 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.568 HD13 ' OE1' ' A' ' 665' ' ' GLN . 90.6 mt -93.59 -23.26 18.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.785 HD21 ' HG3' ' A' ' 662' ' ' ARG . 30.8 mt -114.83 144.93 42.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -50.06 162.05 0.52 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.635 0.731 . . . . 0.0 110.9 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -31.1 21.07 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.659 2.239 . . . . 0.0 112.345 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 37.3 mtpt -72.16 -45.46 60.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.441 ' OE1' ' CE ' ' A' ' 663' ' ' MET . 18.8 mm-40 -60.12 -52.95 63.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.878 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.519 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 10.4 mtp180 -35.3 -48.64 0.47 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.839 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.27 -47.26 62.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.928 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -56.66 -60.77 3.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 94.2 t -55.31 -38.88 49.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.137 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.426 ' O ' HG23 ' A' ' 710' ' ' VAL . 43.1 t80 -62.93 -37.26 86.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.851 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -64.76 -58.01 7.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.845 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 708' ' ' GLN . . . . . 0.477 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 10.4 pt20 -53.87 -37.02 63.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.925 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.477 ' N ' ' HG3' ' A' ' 708' ' ' GLN . 2.6 t80 -63.87 -43.3 96.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.54 HG13 ' HB1' ' A' ' 677' ' ' ALA . 69.6 t -67.65 -45.08 85.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.104 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -53.25 -48.96 67.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.903 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.99 -34.77 77.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.168 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -66.79 -24.44 66.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.901 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -86.47 -46.77 9.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.071 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 715' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' A' ' 717' ' ' GLU . 10.9 pt-20 -58.12 -41.93 84.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.9 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -40.53 -27.93 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.834 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 717' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' A' ' 715' ' ' GLU . 6.8 mp0 -83.07 98.11 9.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 54.4 mtm180 -130.77 150.48 51.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.896 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.11 113.4 9.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.88 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 58.1 m -107.74 95.99 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.852 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -76.49 -82.75 0.51 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.515 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 154.72 67.15 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.613 2.209 . . . . 0.0 112.37 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 37.9 p -45.19 113.82 0.64 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.79 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 67.5 m -59.78 134.25 56.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.905 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.47 -179.98 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.521 -0.232 . . . . 0.0 112.521 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 29.6 m -162.85 174.21 12.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.879 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 56.4 m -129.71 -47.13 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.861 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 92.92 129.96 5.26 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.476 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 90.1 p -135.0 122.73 22.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.858 0.361 . . . . 0.0 110.836 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 85.8 p -154.3 164.77 38.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.829 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 167.43 84.41 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.478 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -50.93 106.41 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.741 0.305 . . . . 0.0 111.089 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 14.2 mtm105 -125.81 92.69 3.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -52.8 -43.0 65.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.88 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 -80.81 155.47 26.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.856 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -117.7 55.59 0.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.097 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 61.3 mt -114.23 95.69 4.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.121 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 657' ' ' VAL . . . . . 0.512 HG22 ' HB3' ' A' ' 661' ' ' ALA . 12.4 p -56.17 125.21 63.69 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.624 0.726 . . . . 0.0 111.096 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.446 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.6 Cg_endo -69.75 160.8 48.35 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.733 2.289 . . . . 0.0 112.336 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.407 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 15.7 tp -56.03 -48.08 76.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.927 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -54.69 -37.01 65.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.512 ' HB3' HG22 ' A' ' 657' ' ' VAL . . . -66.54 -69.78 0.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.05 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.412 ' HG3' HD21 ' A' ' 697' ' ' LEU . 6.8 ptt180 -49.35 -45.39 45.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.91 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.5 mtt -60.87 -45.09 95.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 1.3 mmmm -55.05 -44.03 74.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -60.48 -62.08 2.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.939 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.716 ' HB2' HD12 ' A' ' 697' ' ' LEU . 20.9 t80 -49.12 -53.02 22.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 35.0 tttt -54.6 -45.6 73.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -51.71 -44.52 63.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.89 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.4 ' O ' ' C ' ' A' ' 670' ' ' LEU . 8.4 mtm -62.3 -63.35 1.26 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.906 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 669' ' ' MET . 49.2 mt -38.49 -40.69 0.59 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 54.8 tp -75.9 -56.12 4.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 672' ' ' GLU . . . . . 0.475 ' O ' ' N ' ' A' ' 674' ' ' GLY . 8.2 mm-40 -59.23 -65.74 0.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 673' ' ' ARG . . . . . 0.41 ' HA ' ' NE ' ' A' ' 673' ' ' ARG . 14.1 mmp_? -39.22 -26.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.854 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 674' ' ' GLY . . . . . 0.475 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 86.44 34.61 11.71 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.503 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.738 HG13 ' HG3' ' A' ' 684' ' ' GLU . 76.7 t -60.29 99.07 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.868 0.366 . . . . 0.0 111.087 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 4.1 m -49.47 151.11 1.66 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -83.68 -26.69 29.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.103 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -102.01 48.12 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -123.97 -175.0 3.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.889 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 40.0 p -107.85 148.43 29.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.1 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 31.2 t-105 -59.56 -29.13 67.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -63.73 -53.69 47.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.831 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.519 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 10.8 mtpp -58.79 -59.06 6.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.738 ' HG3' HG13 ' A' ' 675' ' ' VAL . 64.6 mm-40 -55.32 -37.02 66.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 4.9 tp -54.53 -63.18 1.23 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.796 ' O ' HG12 ' A' ' 689' ' ' VAL . 5.6 p-80 -56.86 -29.26 62.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.809 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -68.13 -32.08 72.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.932 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 11.2 pt -112.78 9.94 8.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.108 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.796 HG12 ' O ' ' A' ' 686' ' ' HIS . 7.9 p -70.02 -24.66 26.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.131 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 10.4 p90 -80.08 -51.9 8.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.869 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.574 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 7.6 t70 -34.0 140.09 0.26 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.591 0.71 . . . . 0.0 110.904 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.67 -38.33 8.15 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.699 2.266 . . . . 0.0 112.357 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.468 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 28.7 mtm180 -65.56 -25.04 67.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.87 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.407 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 19.4 t80 -58.24 -11.59 2.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.897 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 30.9 mt -114.14 25.59 10.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.938 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.468 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 95.9 mt -109.52 -28.46 8.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.716 HD12 ' HB2' ' A' ' 666' ' ' PHE . 32.1 mt -103.21 139.37 38.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.971 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -48.5 162.62 0.35 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.598 0.713 . . . . 0.0 110.946 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -35.43 12.72 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.672 2.248 . . . . 0.0 112.348 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -72.15 -42.47 65.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.918 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 702' ' ' ARG . 26.4 mt-10 -60.0 -51.47 69.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.587 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 40.5 mtp180 -37.93 -51.04 1.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.871 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -66.09 -46.83 76.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.877 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -56.28 -61.06 2.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.882 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 84.6 t -56.19 -41.54 70.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.097 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.466 ' O ' HG23 ' A' ' 710' ' ' VAL . 21.9 t80 -60.32 -44.08 95.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -58.12 -48.07 81.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.853 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -61.11 -45.18 95.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.917 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.523 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 5.5 t80 -55.92 -44.95 78.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 706' ' ' PHE . 90.3 t -62.87 -51.91 65.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.134 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -45.98 -48.38 16.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.899 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.2 p -65.28 -46.54 80.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.145 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.523 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 12.5 mmp_? -59.22 -21.06 58.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -86.42 -59.97 2.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.045 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -46.23 -35.19 4.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.851 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 716' ' ' GLU . . . . . 0.438 ' O ' ' N ' ' A' ' 718' ' ' ARG . 5.5 mm-40 -87.89 30.49 0.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.879 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -53.47 88.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 718' ' ' ARG . . . . . 0.438 ' N ' ' O ' ' A' ' 716' ' ' GLU . 12.7 mmm-85 -98.54 161.69 13.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.857 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -114.53 -48.9 2.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 39.8 t -116.64 148.64 40.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.866 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 107.34 146.23 12.73 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.488 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 144.53 54.1 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.671 2.247 . . . . 0.0 112.349 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 2.8 t -102.33 -44.76 5.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.905 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 88.0 p -82.12 81.29 8.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.838 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.519 179.997 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 7.3 m -65.53 152.44 44.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.92 0.39 . . . . 0.0 110.837 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 57.9 m -103.02 86.48 2.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.873 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 70.68 -144.64 38.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.482 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 58.4 m 38.65 50.05 1.54 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.889 0.376 . . . . 0.0 110.861 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 8.2 t -120.3 104.64 10.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.834 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 98.7 67.95 0.9 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.482 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -96.43 103.59 15.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.779 0.323 . . . . 0.0 111.09 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -135.77 111.85 9.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.864 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -85.21 41.69 0.9 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.875 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 654' ' ' ARG . . . . . 0.502 ' HG3' HD13 ' A' ' 656' ' ' ILE . 38.3 ttm180 -73.19 91.82 1.69 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.891 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -85.97 37.19 0.7 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.107 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 656' ' ' ILE . . . . . 0.502 HD13 ' HG3' ' A' ' 654' ' ' ARG . 5.3 mp -111.83 102.93 14.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.134 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 92.4 t -95.02 123.41 57.47 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.598 0.714 . . . . 0.0 111.178 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.504 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.1 Cg_endo -69.81 159.98 51.38 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.708 2.272 . . . . 0.0 112.331 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 17.5 tp -57.81 -46.8 84.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -55.81 -32.17 63.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.92 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.504 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -70.84 -66.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.122 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.576 ' HG3' HD21 ' A' ' 697' ' ' LEU . 5.8 ptm180 -51.91 -48.84 63.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.913 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 9.1 mtt -57.52 -48.52 79.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.935 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -51.22 -44.71 61.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -59.24 -60.53 3.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.931 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.462 ' CE2' HD11 ' A' ' 670' ' ' LEU . 27.9 t80 -47.72 -59.9 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.88 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -46.24 -50.93 15.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.887 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -48.91 -48.14 42.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 3.8 mtm -56.37 -62.37 1.76 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.907 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.462 HD11 ' CE2' ' A' ' 666' ' ' PHE . 49.4 mt -41.23 -38.72 1.18 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 20.8 tp -72.52 -47.33 49.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.921 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 672' ' ' GLU . . . . . 0.425 ' O ' ' C ' ' A' ' 673' ' ' ARG . 12.3 mm-40 -71.69 -66.02 0.69 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.872 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 673' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 672' ' ' GLU . 13.2 mmt-85 -36.26 -39.26 0.17 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.875 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 100.01 29.61 6.75 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.531 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.621 HG12 ' O ' ' A' ' 675' ' ' VAL . 19.4 t -59.57 87.54 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.877 0.37 . . . . 0.0 111.126 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 676' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 675' ' ' VAL . 50.8 m -37.15 155.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.861 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -100.11 -4.82 28.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.06 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -117.03 36.3 4.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.889 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.1 m -125.13 -177.02 3.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.841 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 2.8 p -94.14 153.52 18.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.156 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.558 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 29.1 t-105 -63.09 -30.56 71.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.879 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.33 -57.17 13.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 9.2 mttp -56.2 -59.09 5.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.509 ' OE1' ' CZ ' ' A' ' 706' ' ' PHE . 8.1 mt-10 -55.4 -43.75 75.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.918 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.558 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 6.4 tp -47.35 -61.75 1.76 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.57 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.8 p-80 -56.32 -35.36 67.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.859 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.515 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 13.4 mtmt -63.67 -25.47 68.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.867 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 13.7 pt -121.07 11.84 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.143 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.57 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.3 p -80.29 -34.68 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.11 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.448 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 4.8 p90 -67.15 -43.28 82.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.906 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.448 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.5 t70 -46.58 139.72 6.11 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.563 0.696 . . . . 0.0 110.848 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.1 Cg_endo -69.74 -42.0 3.81 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.705 2.27 . . . . 0.0 112.318 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 19.6 mtm-85 -56.71 -23.57 43.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.576 ' CE2' ' HD3' ' A' ' 702' ' ' ARG . 0.8 OUTLIER -65.72 -30.12 70.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.911 -179.859 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.427 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 35.7 mt -78.73 -6.46 55.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.889 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.88 -52.74 10.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.576 HD21 ' HG3' ' A' ' 662' ' ' ARG . 11.7 mt -78.21 156.62 29.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -68.64 164.05 48.92 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.645 0.736 . . . . 0.0 110.857 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -35.41 12.73 Favored 'Trans proline' 0 N--CA 1.465 -0.176 0 C-N-CA 122.717 2.278 . . . . 0.0 112.38 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -72.44 -45.65 58.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.892 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.478 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -60.44 -53.47 57.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.576 ' HD3' ' CE2' ' A' ' 694' ' ' TYR . 68.7 mtt180 -34.49 -46.65 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.899 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 4.4 tmtm? -72.15 -46.23 57.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.841 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -56.26 -55.93 27.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.75 -48.41 81.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.158 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.689 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 19.2 t80 -55.43 -45.48 76.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.906 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -55.66 -47.7 76.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.845 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -64.53 -40.86 96.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.908 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.532 ' CZ ' ' HG3' ' A' ' 713' ' ' ARG . 11.7 t80 -63.95 -46.13 86.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.889 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.689 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 68.9 t -63.71 -48.92 84.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.092 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -51.89 -45.52 64.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -41.07 69.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.147 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.532 ' HG3' ' CZ ' ' A' ' 709' ' ' TYR . 4.7 mmp_? -59.23 -33.32 70.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.908 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -81.63 -55.01 4.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.095 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -56.07 -19.15 11.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.894 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 716' ' ' GLU . . . . . 0.424 ' O ' ' N ' ' A' ' 718' ' ' ARG . 8.0 tt0 -103.01 28.85 5.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.926 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -60.81 80.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.897 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 718' ' ' ARG . . . . . 0.424 ' N ' ' O ' ' A' ' 716' ' ' GLU . 4.0 ptt85 -91.3 138.58 31.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.868 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -94.27 142.27 27.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.855 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 40.2 t -79.25 156.04 28.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.859 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -133.42 -86.49 0.28 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.465 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -42.66 3.27 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.684 2.256 . . . . 0.0 112.331 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 97.5 p -76.02 156.88 33.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.852 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 44.6 m -126.68 135.26 50.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.847 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.514 -179.974 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.466 -0.254 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 19.4 t -89.68 135.92 33.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.852 0.358 . . . . 0.0 110.843 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 25.1 p -105.68 118.07 35.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.856 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . -154.12 158.34 28.08 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.488 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 3.4 m -158.78 139.58 12.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.833 0.349 . . . . 0.0 110.89 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 2.3 m -78.66 105.76 10.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.858 -179.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 108.49 122.16 4.65 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.45 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -109.22 115.58 30.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.736 0.303 . . . . 0.0 111.116 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -44.51 -42.06 6.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.86 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 653' ' ' GLU . . . . . 0.674 ' HB2' HD12 ' A' ' 656' ' ' ILE . 7.5 mm-40 -131.65 175.08 9.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.854 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 24.5 mmm180 -106.99 -19.13 13.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.875 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -96.67 36.18 1.42 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.105 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 656' ' ' ILE . . . . . 0.674 HD12 ' HB2' ' A' ' 653' ' ' GLU . 95.1 mt -130.03 113.16 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.124 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 10.6 p -120.41 126.53 26.73 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.596 0.713 . . . . 0.0 111.13 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.53 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.9 Cg_endo -69.71 159.03 54.95 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.691 2.261 . . . . 0.0 112.335 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 43.0 tp -59.42 -49.43 77.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -52.97 -36.58 60.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.53 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -68.69 -69.49 0.32 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.119 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.711 ' HG3' HD21 ' A' ' 697' ' ' LEU . 4.3 ptm180 -47.72 -53.27 15.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.919 ' HA ' HD11 ' A' ' 697' ' ' LEU . 11.4 mtt -53.24 -44.4 68.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.933 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -31.87 70.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -67.45 -59.32 3.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.83 ' HB2' HD12 ' A' ' 697' ' ' LEU . 26.5 t80 -55.03 -55.82 26.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.889 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 667' ' ' LYS . . . . . 0.518 ' HA ' HD12 ' A' ' 670' ' ' LEU . 0.2 OUTLIER -54.8 -44.31 73.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.865 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -52.15 -52.75 49.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.859 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.489 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 3.0 ptt? -67.73 -39.09 84.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.908 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 667' ' ' LYS . 24.9 mt -47.52 -46.98 28.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.925 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.7 tp -79.62 -48.2 14.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 672' ' ' GLU . . . . . 0.433 ' O ' ' N ' ' A' ' 674' ' ' GLY . 27.9 mm-40 -55.6 -66.02 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.897 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 9.1 mmp_? -42.76 -23.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.872 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 674' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 87.33 43.99 5.72 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.485 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.458 HG13 ' CG ' ' A' ' 684' ' ' GLU . 87.9 t -71.25 101.42 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.861 0.363 . . . . 0.0 111.18 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 3.2 t -61.35 154.93 22.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.891 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 677' ' ' ALA . . . . . 0.557 ' HA ' HG13 ' A' ' 710' ' ' VAL . . . -87.3 -47.88 8.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.089 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -58.56 -27.06 64.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 39.2 m -65.96 167.55 9.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 30.3 p -92.29 163.34 13.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.14 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 4.4 t-105 -67.31 -31.5 71.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.923 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -58.83 -56.9 16.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.846 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -56.52 -59.03 5.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.934 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.458 ' CG ' HG13 ' A' ' 675' ' ' VAL . 63.1 mm-40 -53.94 -40.68 67.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 5.7 tp -52.09 -59.12 4.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.932 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.7 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.6 p-80 -56.49 -33.31 65.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.83 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 48.0 mttt -65.56 -31.7 72.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 12.5 pt -112.83 11.07 8.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.11 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.7 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.3 p -76.69 -32.9 21.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.171 179.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -74.99 -28.66 60.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.879 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.431 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 11.6 t70 -63.4 139.81 97.63 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.585 0.707 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.2 Cg_endo -69.77 -40.63 5.08 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.703 2.269 . . . . 0.0 112.324 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 36.7 mtm180 -57.99 -22.14 48.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.834 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.637 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 11.6 t80 -67.13 -3.56 7.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.94 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 28.2 mt -111.49 -13.95 13.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.904 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.56 -46.05 90.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.928 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.919 HD11 ' HA ' ' A' ' 663' ' ' MET . 30.1 mt -93.68 140.54 29.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -48.87 162.81 0.36 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.599 0.714 . . . . 0.0 110.924 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 699' ' ' PRO . . . . . 0.462 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.6 Cg_endo -69.76 -32.18 19.07 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.738 2.292 . . . . 0.0 112.338 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -72.23 -46.92 54.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.861 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.0 -49.84 75.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.879 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.637 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 56.8 mtm180 -42.66 -43.5 3.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.87 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -71.2 -42.86 68.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.903 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -60.4 -57.31 13.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 74.5 t -56.91 -43.69 80.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.118 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.677 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 20.9 t80 -61.74 -43.39 98.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.891 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -55.59 -49.0 73.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -63.47 -38.05 89.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.593 ' C ' ' CD1' ' A' ' 709' ' ' TYR . 0.3 OUTLIER -66.69 -38.15 86.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.927 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.677 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 99.4 t -72.98 -53.7 17.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.137 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -49.42 -51.61 34.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.888 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 10.6 p -66.25 -36.56 83.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.15 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.565 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 9.9 mmm180 -66.02 -34.35 77.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.884 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -75.67 -52.19 11.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.082 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 715' ' ' GLU . . . . . 0.413 ' CG ' ' N ' ' A' ' 716' ' ' GLU . 9.1 pt-20 -54.33 -42.5 70.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.872 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 716' ' ' GLU . . . . . 0.443 ' O ' ' C ' ' A' ' 717' ' ' GLU . 13.0 mt-10 -84.16 23.87 1.01 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 717' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 716' ' ' GLU . 11.7 pt-20 -34.32 128.96 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 18.0 mtp85 -117.73 115.9 25.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.85 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -71.97 102.51 2.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.873 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 4.2 t 66.83 41.15 2.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.819 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -71.59 -159.09 3.6 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.482 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 161.19 46.9 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.657 2.238 . . . . 0.0 112.381 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 50.3 p -112.29 -44.0 3.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.839 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 37.1 p -99.17 152.71 19.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.807 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.491 179.99 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 N-CA-C 112.446 -0.261 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 37.0 t -110.76 104.17 12.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.875 0.369 . . . . 0.0 110.896 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 50.6 p -80.19 149.7 30.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.915 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . -142.55 63.71 0.5 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.471 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 36.4 p -103.49 116.77 33.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.844 0.354 . . . . 0.0 110.852 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 46.6 t -73.66 143.67 46.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.864 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -67.43 -136.64 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.505 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -137.11 165.53 25.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.815 0.341 . . . . 0.0 111.103 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 88.2 mtt-85 -118.63 -55.15 2.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -118.68 151.44 37.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -112.32 130.33 55.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.85 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -116.0 178.76 4.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.081 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 51.8 mt -90.71 93.85 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.15 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 657' ' ' VAL . . . . . 0.607 ' HB ' ' HB3' ' A' ' 661' ' ' ALA . 2.9 m -61.42 151.78 75.87 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.632 0.73 . . . . 0.0 111.146 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.61 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.1 Cg_endo -69.76 149.19 66.59 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.721 2.281 . . . . 0.0 112.345 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 21.4 tp -44.25 -36.56 2.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.933 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -71.24 -31.72 67.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.882 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.61 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -66.25 -55.79 14.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.121 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.505 ' HD2' HG23 ' A' ' 657' ' ' VAL . 0.0 OUTLIER -60.22 -54.87 40.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.869 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.833 ' HA ' HD11 ' A' ' 697' ' ' LEU . 16.1 mtt -51.05 -47.6 61.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.887 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.54 -45.43 73.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.921 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -59.69 -50.63 73.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.898 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.553 ' CE2' HD11 ' A' ' 670' ' ' LEU . 30.9 t80 -57.74 -58.98 5.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -51.14 -37.69 47.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.891 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -58.24 -52.52 65.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.852 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 693' ' ' ARG . 2.8 ptt? -67.31 -35.82 80.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.909 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' A' ' 666' ' ' PHE . 20.0 mt -52.45 -52.56 53.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.93 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 671' ' ' LEU . . . . . 0.407 HD13 ' HE ' ' A' ' 713' ' ' ARG . 13.2 tp -78.09 -43.16 29.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -55.31 -65.63 0.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.903 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 10.2 mmp_? -45.86 -26.14 0.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 92.12 38.36 5.72 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.518 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.608 HG13 ' CG ' ' A' ' 684' ' ' GLU . 42.0 t -61.06 112.47 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 111.17 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 16.1 m -70.22 127.51 33.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.878 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -67.97 -53.35 26.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.124 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 678' ' ' PHE . . . . . 0.455 ' CZ ' ' OE2' ' A' ' 717' ' ' GLU . 74.3 m-85 -51.59 -32.32 28.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.934 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.3 m -62.08 -178.69 0.17 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.804 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 16.9 p -102.5 167.31 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.104 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.464 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 32.6 t-105 -66.9 -24.75 66.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.913 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -64.0 -63.12 1.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.916 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.01 -58.97 4.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.608 ' CG ' HG13 ' A' ' 675' ' ' VAL . 50.0 mm-40 -56.67 -44.63 81.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.866 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.464 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.4 tp -48.22 -50.49 29.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.982 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.764 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.2 p-80 -65.9 -33.87 76.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.577 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 51.7 mttt -65.94 -23.6 66.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.832 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 7.2 pt -117.8 3.17 7.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.182 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.764 HG12 ' O ' ' A' ' 686' ' ' HIS . 7.9 p -68.2 -33.13 58.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.099 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -84.26 5.29 27.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.876 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.488 ' OD1' ' N ' ' A' ' 693' ' ' ARG . 4.7 t70 -92.72 142.63 25.91 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.625 0.726 . . . . 0.0 110.862 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.418 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.9 Cg_endo -69.72 -47.84 0.86 Allowed 'Trans proline' 0 N--CA 1.465 -0.197 0 C-N-CA 122.705 2.27 . . . . 0.0 112.385 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.493 ' HA ' HD12 ' A' ' 696' ' ' LEU . 79.1 mtm180 -53.07 -25.29 12.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.469 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 19.6 t80 -65.66 -5.23 7.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.923 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 30.8 mt -118.05 10.95 13.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.905 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' A' ' 693' ' ' ARG . 94.1 mt -94.12 -31.79 14.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.833 HD11 ' HA ' ' A' ' 663' ' ' MET . 40.1 mt -102.56 141.09 35.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.969 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 -47.5 162.36 0.3 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.667 0.746 . . . . 0.0 110.853 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 699' ' ' PRO . . . . . 0.42 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.0 Cg_endo -69.72 -34.16 15.27 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.651 2.234 . . . . 0.0 112.374 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -72.27 -44.56 62.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.461 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -62.02 -49.64 75.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.432 ' NH1' ' O ' ' A' ' 694' ' ' TYR . 43.3 mtm180 -42.7 -44.69 4.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.903 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 7.7 tppt? -69.3 -46.33 67.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -57.03 -55.07 39.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.881 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.6 t -58.68 -37.47 65.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.105 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.567 ' O ' HG23 ' A' ' 710' ' ' VAL . 75.0 t80 -67.27 -34.6 77.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -64.7 -54.22 34.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.883 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 708' ' ' GLN . . . . . 0.461 ' CG ' ' N ' ' A' ' 709' ' ' TYR . 7.6 pt20 -57.84 -45.38 86.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.941 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.693 ' CD2' ' CZ ' ' A' ' 713' ' ' ARG . 2.7 t80 -56.99 -52.71 64.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.922 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 706' ' ' PHE . 92.3 t -59.66 -39.23 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.168 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -53.54 -51.25 63.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.967 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 712' ' ' THR . . . . . 0.436 ' O ' ' N ' ' A' ' 714' ' ' ALA . 20.3 p -70.03 -67.12 0.51 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.156 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.693 ' CZ ' ' CD2' ' A' ' 709' ' ' TYR . 10.4 mpt_? -42.34 -23.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.869 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 714' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 712' ' ' THR . . . -90.22 -54.52 3.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.1 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -30.02 62.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.87 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -87.35 22.12 2.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 717' ' ' GLU . . . . . 0.455 ' OE2' ' CZ ' ' A' ' 678' ' ' PHE . 4.7 tp10 -45.58 116.59 1.21 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.869 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 718' ' ' ARG . . . . . 0.452 ' C ' ' O ' ' A' ' 717' ' ' GLU . 11.7 ttt180 -34.29 122.69 0.5 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.895 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 22.8 ttp180 -77.96 153.71 32.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.866 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 3.2 t -75.98 -59.09 2.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.853 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -48.32 157.66 0.93 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.445 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 127.71 14.98 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.647 2.231 . . . . 0.0 112.355 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 2.5 t -95.81 -47.42 6.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.863 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 54.7 p -107.48 160.09 15.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.891 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.3 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.454 179.988 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.467 -0.253 . . . . 0.0 112.467 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 2.2 m -81.4 170.92 15.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.876 0.369 . . . . 0.0 110.858 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 74.4 m -103.29 -43.65 5.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.867 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 103.86 -173.52 21.77 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.505 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 80.5 p -164.22 174.05 11.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.925 0.393 . . . . 0.0 110.868 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 46.9 p -138.92 122.94 17.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.826 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 60.11 58.74 12.51 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.465 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -104.77 126.77 52.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.807 0.337 . . . . 0.0 111.081 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.92 150.07 49.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.9 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -110.88 39.33 2.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.902 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 51.8 mtm180 -71.3 -52.53 18.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.856 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -42.79 156.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.088 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 5.0 mp -96.92 94.61 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.128 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 82.5 t -52.01 127.84 37.15 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.629 0.728 . . . . 0.0 111.137 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.5 Cg_endo -69.75 158.18 57.85 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.712 2.274 . . . . 0.0 112.3 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 25.6 tp -56.07 -47.29 78.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 660' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 661' ' ' ALA . 8.1 pt-20 -56.35 -36.0 68.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 661' ' ' ALA . . . . . 0.536 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -68.39 -71.04 0.23 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.105 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -46.92 -48.96 21.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.839 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.436 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.4 mtt -55.25 -49.09 72.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.859 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.71 -48.23 50.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.939 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 665' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' A' ' 669' ' ' MET . 72.5 mt-30 -56.7 -61.21 2.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.901 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.557 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 21.2 t80 -43.53 -60.62 1.67 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -51.04 -47.71 61.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.902 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -50.18 -41.15 48.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.915 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.403 ' HG3' ' O ' ' A' ' 665' ' ' GLN . 4.4 mtm -65.4 -63.42 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.864 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 57.3 mt -39.38 -40.11 0.76 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.919 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 19.8 tp -76.64 -45.9 28.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.928 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -65.22 -62.77 1.34 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -46.23 -21.81 0.19 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.898 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 84.29 42.68 7.36 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.506 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.66 HG13 ' CG ' ' A' ' 684' ' ' GLU . 37.3 t -70.01 100.61 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.837 0.351 . . . . 0.0 111.115 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 20.3 m -56.2 141.22 41.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.843 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -77.85 -37.87 47.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.07 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -81.47 44.92 0.83 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.902 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.7 m -133.67 -177.2 4.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.896 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 680' ' ' THR . . . . . 0.626 HG23 ' H ' ' A' ' 683' ' ' LYS . 5.2 t -99.1 154.14 18.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.154 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.558 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 3.3 t-105 -65.47 -32.63 74.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -57.97 -48.89 78.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.918 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.626 ' H ' HG23 ' A' ' 680' ' ' THR . 32.4 mttm -62.85 -59.02 5.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.909 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.66 ' CG ' HG13 ' A' ' 675' ' ' VAL . 56.0 mm-40 -55.76 -37.3 68.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.558 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 8.0 tp -56.58 -62.94 1.38 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.919 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.756 ' O ' HG12 ' A' ' 689' ' ' VAL . 2.1 p-80 -51.72 -36.01 45.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.582 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 37.5 mttm -64.26 -33.47 75.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.918 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 23.9 pt -108.09 10.06 9.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.092 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.756 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.3 p -78.17 -11.71 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.115 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.424 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 11.4 p90 -90.49 -41.61 11.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.879 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.424 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 10.6 t70 -53.59 139.8 48.77 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.595 0.712 . . . . 0.0 110.875 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.8 Cg_endo -69.76 -42.49 3.35 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.659 2.239 . . . . 0.0 112.372 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.459 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 22.4 mtm-85 -53.41 -20.66 4.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.897 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.576 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 40.3 t80 -63.3 -25.56 68.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.884 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 28.6 mt -85.73 -20.26 29.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.944 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.459 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 78.8 mt -59.27 -47.65 84.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.967 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 663' ' ' MET . 10.8 mt -85.18 145.1 27.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.884 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -60.55 164.16 7.65 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.646 0.736 . . . . 0.0 110.861 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 699' ' ' PRO . . . . . 0.415 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.2 Cg_endo -69.67 -34.05 15.66 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.642 2.228 . . . . 0.0 112.394 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -72.38 -47.03 52.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.414 ' O ' ' C ' ' A' ' 702' ' ' ARG . 6.0 mm-40 -61.46 -54.17 46.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.821 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.576 ' NH1' ' CE2' ' A' ' 694' ' ' TYR . 30.6 mtm180 -37.1 -45.04 0.58 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.924 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 3.2 tppt? -70.27 -45.8 65.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.924 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -60.84 -58.98 6.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.887 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 44.1 t -50.68 -52.54 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.146 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.412 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 20.2 t80 -51.1 -55.14 19.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.858 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -45.49 -51.18 12.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -60.63 -44.42 96.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.939 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.467 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 1.5 t80 -56.97 -42.63 80.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.951 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.412 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 85.0 t -66.3 -39.3 83.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.137 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 46.9 tttt -58.82 -41.34 86.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.87 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.8 p -73.74 -41.68 62.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.477 ' HA ' ' CZ ' ' A' ' 713' ' ' ARG . 0.1 OUTLIER -66.3 -27.0 67.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.861 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -83.69 -52.77 6.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.102 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -53.19 -41.91 65.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -46.71 -21.5 0.2 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.869 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.6 110.04 3.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.884 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -40.63 140.19 0.71 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.848 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -97.38 129.79 44.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 80.1 p -91.68 151.99 20.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.86 -179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -117.72 146.23 18.63 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.517 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -12.14 32.26 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.689 2.259 . . . . 0.0 112.336 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 15.9 m -72.93 113.92 10.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.864 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 32.8 t -41.76 161.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.865 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.274 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.482 -179.964 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 N-CA-C 112.512 -0.235 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 23.2 t -115.71 134.88 54.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.872 0.368 . . . . 0.0 110.848 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 20.1 t -169.28 113.78 0.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.855 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 166.14 122.76 0.62 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.492 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 69.3 m -151.18 147.87 27.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.902 0.382 . . . . 0.0 110.853 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 78.3 p -121.73 160.66 24.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.88 -179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 38.76 88.68 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.5 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 651' ' ' ALA . . . . . 0.645 ' HB1' ' OE2' ' A' ' 653' ' ' GLU . . . -117.48 98.63 6.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 111.095 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -122.31 47.92 1.83 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.861 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 653' ' ' GLU . . . . . 0.645 ' OE2' ' HB1' ' A' ' 651' ' ' ALA . 2.0 pm0 -92.82 72.36 4.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 30.0 ttt180 -67.95 -61.24 1.96 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -106.38 46.08 0.94 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 656' ' ' ILE . . . . . 0.719 HG22 ' HD3' ' A' ' 658' ' ' PRO . 94.0 mt -138.8 109.88 5.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.08 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 75.6 t -121.11 81.89 36.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.642 0.734 . . . . 0.0 111.133 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 658' ' ' PRO . . . . . 0.719 ' HD3' HG22 ' A' ' 656' ' ' ILE . 54.0 Cg_endo -69.73 161.72 44.85 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.746 2.297 . . . . 0.0 112.33 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 36.2 tp -53.48 -47.35 69.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.912 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 660' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 1.5 mp0 -56.53 -34.2 66.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.874 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.97 -67.93 0.43 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.046 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 662' ' ' ARG . . . . . 0.471 ' HE ' HD23 ' A' ' 697' ' ' LEU . 6.4 ptm180 -48.62 -55.69 10.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.921 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.9 mtt -54.15 -47.18 72.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.867 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 664' ' ' LYS . . . . . 0.439 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 11.7 mmmt -51.18 -48.88 61.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.869 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -56.44 -60.72 3.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.933 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 666' ' ' PHE . . . . . 0.477 ' CE2' HD11 ' A' ' 670' ' ' LEU . 19.3 t80 -46.41 -62.01 1.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 57.5 tttt -47.55 -49.18 27.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.914 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -47.62 -49.63 26.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.867 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 669' ' ' MET . . . . . 0.454 ' O ' ' N ' ' A' ' 672' ' ' GLU . 4.6 mtm -59.07 -64.51 0.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.849 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 670' ' ' LEU . . . . . 0.477 HD11 ' CE2' ' A' ' 666' ' ' PHE . 50.4 mt -37.54 -41.7 0.48 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.916 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 23.4 tp -76.8 -38.76 53.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.909 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 672' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' A' ' 669' ' ' MET . 5.7 mm-40 -73.29 -65.98 0.74 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.888 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 673' ' ' ARG . . . . . 0.434 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 5.4 mmp_? -39.63 -33.91 0.21 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.837 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 97.89 25.09 10.87 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.48 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 675' ' ' VAL . . . . . 0.624 HG13 ' CD ' ' A' ' 684' ' ' GLU . 39.8 t -51.82 97.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.84 0.353 . . . . 0.0 111.103 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 43.4 m -54.75 132.14 45.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -64.95 -47.55 77.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.098 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -76.85 48.02 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.867 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.3 t -130.84 176.61 8.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.901 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 61.1 p -94.51 142.1 27.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.107 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 681' ' ' TRP . . . . . 0.521 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 34.9 t-105 -57.12 -31.65 65.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.964 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -60.32 -56.01 26.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.881 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 683' ' ' LYS . . . . . 0.603 ' HA ' ' CD2' ' A' ' 686' ' ' HIS . 44.6 mttt -57.99 -59.01 5.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.908 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 684' ' ' GLU . . . . . 0.624 ' CD ' HG13 ' A' ' 675' ' ' VAL . 21.6 mm-40 -56.04 -41.04 74.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.898 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 685' ' ' LEU . . . . . 0.521 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 9.4 tp -50.63 -58.88 4.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.935 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 686' ' ' HIS . . . . . 0.603 ' CD2' ' HA ' ' A' ' 683' ' ' LYS . 5.0 p80 -60.62 -29.96 69.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.86 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 687' ' ' LYS . . . . . 0.442 ' HG3' ' CE1' ' A' ' 686' ' ' HIS . 66.4 mttt -67.03 -27.59 67.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.943 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 13.1 pt -117.97 8.3 6.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.104 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.588 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.0 p -74.84 -28.36 21.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.157 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 690' ' ' PHE . . . . . 0.465 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 13.6 p90 -73.49 -44.53 57.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.845 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 691' ' ' ASP . . . . . 0.465 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.8 t70 -40.82 139.77 1.14 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.627 0.727 . . . . 0.0 110.861 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 692' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.77 -39.17 6.8 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.679 2.253 . . . . 0.0 112.339 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 693' ' ' ARG . . . . . 0.477 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 79.4 mtm180 -61.36 -27.19 68.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.809 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 694' ' ' TYR . . . . . 0.519 ' CD1' ' C ' ' A' ' 694' ' ' TYR . 1.4 t80 -62.7 -23.62 67.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.923 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.418 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 20.2 mt -91.17 9.26 31.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.953 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 696' ' ' LEU . . . . . 0.477 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 89.6 mt -89.77 -40.84 12.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 697' ' ' LEU . . . . . 0.471 HD23 ' HE ' ' A' ' 662' ' ' ARG . 60.7 mt -91.97 166.0 12.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.894 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 698' ' ' ASN . . . . . 0.503 ' ND2' ' OE2' ' A' ' 701' ' ' GLU . 0.2 OUTLIER -78.58 165.39 50.1 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.623 0.725 . . . . 0.0 110.89 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 699' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 698' ' ' ASN . 53.7 Cg_endo -69.77 -26.11 27.88 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.725 2.283 . . . . 0.0 112.353 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -72.47 -47.8 45.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.915 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 701' ' ' GLU . . . . . 0.503 ' OE2' ' ND2' ' A' ' 698' ' ' ASN . 0.0 OUTLIER -66.17 -52.75 45.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.887 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 702' ' ' ARG . . . . . 0.449 ' NH2' ' O ' ' A' ' 697' ' ' LEU . 79.8 mtt180 -35.13 -44.66 0.26 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.874 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 19.3 tptp -74.48 -48.76 25.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -55.81 -57.73 10.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.94 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 89.9 t -56.71 -49.86 76.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.112 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 706' ' ' PHE . . . . . 0.512 ' CD2' ' CE3' ' A' ' 681' ' ' TRP . 20.1 t80 -53.22 -41.15 65.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.85 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.37 -46.19 91.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.866 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -61.03 -39.86 91.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.916 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 709' ' ' TYR . . . . . 0.461 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 22.7 t80 -63.06 -43.25 99.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.917 -179.871 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 710' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 706' ' ' PHE . 86.8 t -63.49 -48.93 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.087 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 35.9 tttt -54.11 -48.54 70.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 2.3 p -66.58 -37.25 84.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.159 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 713' ' ' ARG . . . . . 0.461 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.2 mmm180 -66.54 -28.24 68.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -79.18 -54.87 5.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.156 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -55.33 -33.37 63.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.831 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -91.9 26.37 2.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.874 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -49.35 100.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 17.6 mtp180 -109.34 162.99 13.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.867 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -130.95 84.38 2.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.863 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 2.4 t -166.44 163.26 17.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.865 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 67.68 -163.89 46.36 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.515 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -179.54 2.99 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.691 2.261 . . . . 0.0 112.318 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 63.3 p -131.84 133.63 44.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 72.8 m -100.66 150.68 22.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.862 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.496 -179.974 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.514 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.171 0 CA-C-O 120.819 0.258 . . . . 0.0 112.347 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 14.8 tp -56.02 -47.3 78.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -58.01 -33.69 69.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.867 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.514 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -67.45 -67.17 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.104 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.806 ' HG3' HD21 ' A' ' 697' ' ' LEU . 14.9 ptt180 -53.82 -47.22 71.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.849 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.436 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.3 mtt -54.99 -41.35 71.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -61.58 -43.48 98.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -57.47 -57.89 10.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.951 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.635 ' CD1' ' HE2' ' A' ' 669' ' ' MET . 25.1 t80 -51.99 -52.49 50.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.898 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.406 ' HA ' HD12 ' A' ' 670' ' ' LEU . 12.4 ttmt -55.89 -37.21 68.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.905 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.86 -52.16 66.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.838 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.635 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 2.8 ptt? -66.92 -37.46 84.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.454 HD11 ' CE2' ' A' ' 666' ' ' PHE . 29.6 mt -52.25 -48.86 64.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.938 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.8 tp -77.5 -45.75 24.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -57.1 -66.04 0.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 10.4 mmp_? -43.76 -25.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.872 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 89.2 43.84 5.19 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.515 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.452 HG13 ' CG ' ' A' ' 684' ' ' GLU . 40.4 t -68.06 97.87 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.853 0.359 . . . . 0.0 111.128 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 8.7 t -51.42 143.92 10.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.815 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -80.89 -42.08 22.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.133 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -82.94 47.67 1.25 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.885 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.8 m -131.9 -178.62 4.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.856 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . 0.482 HG23 ' H ' ' A' ' 683' ' ' LYS . 1.7 t -101.7 151.45 22.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.125 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.411 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 26.1 t-105 -59.43 -25.59 64.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.957 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.58 -56.64 14.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.904 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.482 ' H ' HG23 ' A' ' 680' ' ' THR . 38.4 mttp -56.13 -59.04 5.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.882 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.452 ' CG ' HG13 ' A' ' 675' ' ' VAL . 37.7 mm-40 -54.92 -40.6 70.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.908 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.411 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 11.7 tp -51.77 -59.41 4.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.883 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.594 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.1 p-80 -59.2 -29.81 67.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.475 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 45.9 mttm -68.03 -28.12 67.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.849 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 25.3 pt -117.88 10.45 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.113 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.594 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.7 p -74.4 -37.6 45.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.091 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.475 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 7.2 p90 -80.5 9.41 6.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.868 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.423 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 10.0 t70 -93.68 139.81 22.88 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.595 0.712 . . . . 0.0 110.858 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.9 Cg_endo -69.8 -43.06 2.85 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.671 2.247 . . . . 0.0 112.358 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.479 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 70.9 mtm180 -58.47 -21.66 52.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.644 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 1.8 t80 -67.04 -18.69 65.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 12.2 mt -97.29 7.26 46.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.479 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 83.4 mt -91.13 -31.2 16.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.806 HD21 ' HG3' ' A' ' 662' ' ' ARG . 27.2 mt -104.12 152.39 22.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.894 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -57.31 161.86 4.99 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.693 0.758 . . . . 0.0 110.887 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 -37.23 9.52 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.696 2.264 . . . . 0.0 112.362 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -72.1 -45.52 60.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' A' ' 702' ' ' ARG . 36.9 mt-10 -56.95 -53.15 61.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.899 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.644 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 47.5 mtt180 -36.28 -52.24 0.8 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.837 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -65.38 -45.07 85.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -56.35 -57.89 10.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.04 -29.98 42.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.109 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.411 ' O ' HG23 ' A' ' 710' ' ' VAL . 43.1 t80 -71.08 -47.95 55.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -55.89 -52.64 63.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.881 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -60.33 -41.8 94.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.893 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -58.99 -41.22 87.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.858 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 706' ' ' PHE . 78.2 t -68.95 -43.04 82.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.067 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -53.23 -51.25 62.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.894 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 47.3 p -66.74 -35.73 80.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.149 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.409 ' HA ' ' NE ' ' A' ' 713' ' ' ARG . 5.0 mmp_? -66.45 -29.47 69.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.14 179.894 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.401 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.1 Cg_endo . . . . . 0 C--O 1.232 0.195 0 CA-C-O 120.806 0.252 . . . . 0.0 112.335 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 26.4 tp -46.22 -47.58 17.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.933 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -57.65 -35.68 70.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.909 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.401 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -67.68 -70.46 0.26 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.104 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.635 ' HG3' HD21 ' A' ' 697' ' ' LEU . 5.2 ptm180 -46.8 -51.63 16.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.885 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.693 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.1 mtt -56.97 -50.1 73.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.87 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -51.25 -41.83 60.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.899 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -61.49 -65.45 0.69 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.912 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.751 ' HB2' HD12 ' A' ' 697' ' ' LEU . 21.6 t80 -44.81 -49.12 10.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 43.7 tttt -63.22 -42.26 99.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -52.83 -36.39 58.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.41 ' HG2' ' NH1' ' A' ' 693' ' ' ARG . 6.3 mtm -73.81 -60.54 2.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 54.3 mt -39.23 -42.32 0.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.948 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.2 tp -78.46 -50.45 11.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.918 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -59.73 -65.91 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.858 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -41.83 -32.84 0.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.896 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 96.24 31.4 7.24 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.489 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.79 HG13 ' HG2' ' A' ' 684' ' ' GLU . 69.6 t -55.11 103.44 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.874 0.368 . . . . 0.0 111.116 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 59.3 m -59.3 137.51 57.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -72.96 1.6 8.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.092 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -121.86 24.02 9.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.88 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.6 t -105.72 161.95 13.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.839 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 11.5 p -88.66 147.8 24.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.172 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.492 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 56.1 t-105 -50.98 -28.07 9.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.9 -61.74 2.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.896 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.569 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 0.6 OUTLIER -54.54 -59.06 5.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.79 ' HG2' HG13 ' A' ' 675' ' ' VAL . 9.0 mt-10 -54.8 -41.05 70.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.916 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.492 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 8.1 tp -52.43 -68.59 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.569 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 4.4 p-80 -50.18 -31.64 14.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.861 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.401 ' HG3' ' NE2' ' A' ' 686' ' ' HIS . 45.6 mttt -68.35 -28.29 67.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 24.3 pt -119.15 15.48 6.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.14 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.498 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -83.85 -39.36 14.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.141 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.409 ' N ' ' CG1' ' A' ' 689' ' ' VAL . 15.4 p90 -68.24 -20.93 64.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.868 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.42 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.6 t70 -72.11 139.75 82.47 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.619 0.723 . . . . 0.0 110.873 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.77 -38.74 7.36 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.681 2.254 . . . . 0.0 112.367 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.551 ' HA ' HD12 ' A' ' 696' ' ' LEU . 59.4 mtm180 -53.84 -27.49 30.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.868 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.644 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 15.7 t80 -63.0 -23.41 67.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.93 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 17.4 mt -100.75 18.03 20.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.95 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 693' ' ' ARG . 74.2 mt -99.93 -41.53 7.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.909 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.751 HD12 ' HB2' ' A' ' 666' ' ' PHE . 29.2 mt -89.67 146.51 24.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.904 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 9.6 m-20 -47.09 161.47 0.3 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.627 0.727 . . . . 0.0 110.895 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -37.04 9.83 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.698 2.265 . . . . 0.0 112.34 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.02 -37.69 69.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.948 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.437 ' O ' ' C ' ' A' ' 702' ' ' ARG . 8.3 mt-10 -62.53 -55.3 28.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.879 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.644 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 50.1 mtm180 -34.5 -47.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.862 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 9.4 tppt? -71.2 -46.95 60.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.885 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -57.88 -59.98 4.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.901 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 96.1 t -52.62 -50.72 39.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.13 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.413 ' CZ ' ' OE1' ' A' ' 684' ' ' GLU . 20.9 t80 -49.11 -46.06 44.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.898 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -57.8 -54.78 43.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.881 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -52.84 -47.3 67.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.895 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.531 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 12.3 t80 -52.53 -51.03 61.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.951 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 41.1 t -58.02 -50.7 77.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.115 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -44.69 -56.42 4.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.908 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 39.7 p -60.35 -47.33 86.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.116 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.531 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.1 mmm180 -54.72 -21.73 11.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.054 179.949 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.551 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.5 Cg_endo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.83 0.263 . . . . 0.0 112.329 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 17.7 tp -58.78 -50.72 72.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . 0.47 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 6.0 tp10 -51.26 -34.43 32.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.551 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -70.62 -71.07 0.26 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.085 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -48.01 -49.79 29.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.864 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.682 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.9 mtt -55.91 -45.7 78.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.878 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . 0.47 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 8.5 mmmt -55.83 -42.26 75.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.4 -56.52 21.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.589 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 25.8 t80 -50.15 -49.71 51.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 33.8 tttt -62.16 -36.71 82.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -45.21 92.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.866 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.459 ' CG ' ' O ' ' A' ' 666' ' ' PHE . 3.0 ptt? -72.26 -38.67 68.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.9 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 25.3 mt -52.17 -47.49 65.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.954 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 22.0 tp -77.02 -50.36 13.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.94 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -53.19 -66.05 0.45 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.885 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -43.95 -31.36 0.87 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.874 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 96.25 45.9 2.7 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.502 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.408 HG13 ' CG ' ' A' ' 684' ' ' GLU . 74.7 t -72.4 89.57 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.857 0.36 . . . . 0.0 111.12 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 41.9 m -56.83 123.84 16.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.871 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . 0.86 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -56.62 -31.8 64.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.072 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -70.0 -22.88 63.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.871 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 24.5 t -67.1 173.62 3.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.845 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 25.2 p -104.42 158.21 16.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.165 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.461 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 44.9 t-105 -59.87 -33.19 71.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -60.97 -58.6 7.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.92 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.489 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 63.6 mttt -57.15 -59.06 5.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.843 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.408 ' CG ' HG13 ' A' ' 675' ' ' VAL . 13.2 mt-10 -55.5 -38.28 68.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.853 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.461 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 5.1 tp -53.5 -52.95 57.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.933 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.796 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.0 p-80 -65.52 -29.12 69.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 61.7 mttt -68.72 -33.28 73.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.949 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . 0.417 ' O ' ' CB ' ' A' ' 694' ' ' TYR . 7.5 pt -111.04 6.91 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.137 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.796 HG12 ' O ' ' A' ' 686' ' ' HIS . 8.0 p -66.03 -25.07 35.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.14 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.514 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 9.1 p90 -85.52 -47.15 10.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.514 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.4 t70 -34.28 142.05 0.23 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.626 0.727 . . . . 0.0 110.829 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.414 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.76 -39.32 6.66 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.715 2.276 . . . . 0.0 112.358 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.505 ' HA ' HD12 ' A' ' 696' ' ' LEU . 11.9 mtm-85 -67.19 -21.58 65.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.859 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.417 ' CB ' ' O ' ' A' ' 688' ' ' ILE . 18.8 t80 -63.96 -18.77 64.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 18.9 mt -109.9 23.53 14.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.948 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 693' ' ' ARG . 81.3 mt -105.12 -25.6 12.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.907 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.682 HD11 ' HA ' ' A' ' 663' ' ' MET . 27.9 mt -110.5 144.56 39.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.895 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -50.75 163.12 0.5 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.584 0.707 . . . . 0.0 110.893 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -31.7 20.02 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.706 2.271 . . . . 0.0 112.299 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -45.04 61.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.902 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 5.5 mm-40 -59.07 -54.53 46.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.907 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.589 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 38.1 mtp180 -34.28 -50.43 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -68.0 -45.67 73.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . 0.409 ' N ' ' O ' ' A' ' 701' ' ' GLU . 10.9 mm-40 -58.23 -60.32 3.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.913 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.4 t -54.71 -46.63 73.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.167 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.674 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 25.2 t80 -60.76 -41.4 95.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.907 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -54.92 -53.03 60.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.833 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -61.64 -39.04 89.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.929 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -63.99 -39.07 93.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.937 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.86 HG13 ' HB1' ' A' ' 677' ' ' ALA . 86.6 t -69.6 -53.92 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.114 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 12.8 mtpp -48.14 -48.47 34.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 45.3 p -66.85 -38.95 87.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 12.6 mmt-85 -62.19 -47.16 85.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.104 179.917 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.488 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo . . . . . 0 C--O 1.231 0.169 0 CA-C-O 120.856 0.273 . . . . 0.0 112.323 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 21.9 tp -59.99 -48.82 80.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -51.95 -32.76 34.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.855 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.488 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -74.0 -68.83 0.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.087 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.564 ' HG3' HD21 ' A' ' 697' ' ' LEU . 6.5 ptm180 -48.7 -48.36 40.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.891 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.766 ' HA ' HD11 ' A' ' 697' ' ' LEU . 9.2 mtt -59.05 -51.26 70.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -50.39 -39.37 46.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -63.24 -58.16 8.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.862 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.723 ' HB2' HD12 ' A' ' 697' ' ' LEU . 23.2 t80 -51.9 -43.95 63.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.897 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 34.0 tttp -69.7 -39.25 77.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.859 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -57.67 -43.32 84.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.871 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -71.99 -37.95 69.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.892 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.49 HD23 HG21 ' A' ' 675' ' ' VAL . 27.1 mt -53.86 -46.54 71.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 42.9 tp -75.46 -51.28 13.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.953 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -54.85 -63.62 1.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 12.7 mmp_? -45.78 -24.29 0.36 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.881 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 86.44 44.42 5.87 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.527 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.61 HG13 ' CD ' ' A' ' 684' ' ' GLU . 54.9 t -70.11 107.81 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.812 0.339 . . . . 0.0 111.162 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 39.1 m -63.36 149.87 44.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . 0.604 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -81.4 -52.94 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.131 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -57.79 -13.55 4.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.892 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -75.03 172.37 12.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.862 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 2.4 t -105.25 165.14 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.186 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.49 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 40.6 t-105 -62.73 -26.52 68.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -61.47 -62.11 2.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.405 ' O ' ' ND1' ' A' ' 686' ' ' HIS . 39.8 mttp -53.52 -58.94 5.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.914 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.61 ' CD ' HG13 ' A' ' 675' ' ' VAL . 46.7 mm-40 -55.48 -45.79 76.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.903 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.49 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.7 tp -45.59 -55.11 6.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.906 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.707 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.7 p-80 -64.13 -31.63 72.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.856 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.552 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 56.9 mttm -68.97 -22.84 64.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 8.7 pt -118.48 5.0 6.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.119 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.707 HG12 ' O ' ' A' ' 686' ' ' HIS . 7.9 p -69.9 -27.95 34.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.141 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.552 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 6.7 p90 -86.1 3.66 41.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 693' ' ' ARG . 9.4 t70 -94.96 139.8 22.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.605 0.717 . . . . 0.0 110.864 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.8 -34.02 15.3 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.675 2.25 . . . . 0.0 112.323 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.624 ' HA ' HD12 ' A' ' 696' ' ' LEU . 16.8 mtm-85 -67.49 -20.03 65.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.881 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -65.8 -16.96 64.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.969 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.1 mt -113.27 16.84 18.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.921 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.624 HD12 ' HA ' ' A' ' 693' ' ' ARG . 54.8 mt -96.03 -19.68 19.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.846 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.766 HD11 ' HA ' ' A' ' 663' ' ' MET . 30.8 mt -114.83 148.19 38.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.884 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 -50.1 161.91 0.54 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.6 0.715 . . . . 0.0 110.93 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -33.71 15.93 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.652 2.235 . . . . 0.0 112.288 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -72.01 -45.31 61.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.892 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 71.6 mm-40 -57.47 -53.47 57.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.585 ' HG2' ' CE2' ' A' ' 666' ' ' PHE . 10.7 mtp180 -34.42 -47.95 0.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -71.45 -45.35 62.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.892 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . 0.41 ' N ' ' O ' ' A' ' 701' ' ' GLU . 46.0 mm-40 -57.88 -59.26 5.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.906 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 91.6 t -55.62 -48.37 77.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.126 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.436 ' O ' HG23 ' A' ' 710' ' ' VAL . 26.4 t80 -56.34 -43.8 79.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.917 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -55.32 -53.24 58.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.863 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -58.08 -38.83 77.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.887 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -62.8 -42.78 99.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.917 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.604 HG13 ' HB1' ' A' ' 677' ' ' ALA . 89.2 t -67.36 -41.61 86.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.163 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -59.14 -39.06 81.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.864 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 21.2 p -74.09 -40.38 62.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.123 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -66.17 -26.37 67.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.868 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.094 179.909 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.402 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.9 Cg_endo . . . . . 0 N--CA 1.465 -0.169 0 CA-C-O 120.866 0.277 . . . . 0.0 112.36 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.5 HD12 ' HE ' ' A' ' 662' ' ' ARG . 14.5 tp -51.91 -54.84 24.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.899 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -53.71 -35.86 61.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.402 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -64.0 -70.94 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.125 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.5 ' HE ' HD12 ' A' ' 659' ' ' LEU . 14.7 ptt180 -50.8 -48.14 59.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.831 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.652 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.5 mtt -54.05 -42.73 69.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.873 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -58.85 -47.4 84.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.902 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -55.42 -52.12 64.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.747 ' HB2' HD12 ' A' ' 697' ' ' LEU . 25.1 t80 -54.46 -57.44 11.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.849 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.568 ' HA ' HD12 ' A' ' 670' ' ' LEU . 16.9 ttmt -54.63 -35.98 64.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.968 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -60.1 -52.85 63.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.531 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 2.7 ptt? -65.14 -36.58 84.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.901 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 667' ' ' LYS . 32.0 mt -54.23 -49.35 69.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.889 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 31.2 tp -74.01 -52.02 14.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . 0.435 ' O ' ' N ' ' A' ' 674' ' ' GLY . 19.0 mt-10 -55.09 -65.77 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . 0.415 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 16.1 mmp_? -39.49 -28.54 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.838 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . 0.435 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 93.99 42.85 3.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.511 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.454 HG21 HD23 ' A' ' 670' ' ' LEU . 53.0 t -71.43 94.6 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.874 0.368 . . . . 0.0 111.131 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 57.7 m -58.83 125.41 23.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.85 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -64.72 -32.2 73.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.088 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -83.81 34.72 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.919 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.3 t -125.9 -175.03 3.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.897 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . 0.654 HG23 ' H ' ' A' ' 683' ' ' LYS . 12.9 t -106.17 158.76 16.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.13 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 50.1 t-105 -63.28 -38.07 89.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.887 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -54.28 -57.13 12.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.911 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.654 ' H ' HG23 ' A' ' 680' ' ' THR . 5.9 mtpm? -60.64 -59.62 5.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.905 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -52.55 -34.69 51.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 8.3 tp -59.11 -62.1 2.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.913 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.73 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.5 p-80 -50.58 -35.06 28.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.848 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.584 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 44.0 mttp -63.87 -40.03 95.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.911 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 12.0 pt -105.22 13.9 7.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.137 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.73 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.1 p -79.81 -24.32 12.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.161 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 12.2 p90 -75.42 -44.35 44.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.852 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.471 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 7.3 t70 -53.13 139.42 45.08 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.619 0.723 . . . . 0.0 110.832 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.412 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.2 Cg_endo -69.77 -34.77 13.87 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.715 2.277 . . . . 0.0 112.345 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.527 ' HA ' HD12 ' A' ' 696' ' ' LEU . 36.6 mtm180 -58.41 -17.45 20.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.896 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -66.61 -15.55 63.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.892 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 27.8 mt -103.65 -12.31 17.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.926 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 693' ' ' ARG . 64.7 mt -62.42 -52.76 62.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.747 HD12 ' HB2' ' A' ' 666' ' ' PHE . 30.6 mt -84.67 148.05 26.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -56.22 162.47 3.03 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.634 0.73 . . . . 0.0 110.91 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . 0.555 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.8 Cg_endo -69.7 -32.12 19.43 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.731 2.287 . . . . 0.0 112.352 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 44.1 mttt -72.29 -46.81 54.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.899 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -60.34 -51.76 68.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.92 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.555 HH21 ' N ' ' A' ' 699' ' ' PRO . 44.6 mtm180 -39.27 -45.38 1.39 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.9 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -70.91 -43.49 68.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.907 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -60.89 -59.54 5.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.94 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.8 t -54.65 -41.45 55.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.114 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.566 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 5.3 t80 -60.18 -48.33 82.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -54.02 -47.29 71.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.803 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -65.95 -41.26 91.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.892 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.527 ' CZ ' ' HG3' ' A' ' 713' ' ' ARG . 12.6 t80 -61.82 -47.9 83.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.892 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.566 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 92.9 t -59.46 -43.99 91.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.1 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -57.31 -49.2 76.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.915 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 13.8 p -64.63 -41.46 96.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.128 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.527 ' HG3' ' CZ ' ' A' ' 709' ' ' TYR . 3.4 mmp_? -64.63 -36.62 84.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.888 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.113 179.91 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.529 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.847 0.27 . . . . 0.0 112.347 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.444 HD12 ' HE ' ' A' ' 662' ' ' ARG . 10.4 tp -58.47 -48.62 80.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -55.36 -37.51 67.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.529 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -63.76 -66.1 0.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.124 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.802 ' HG3' HD21 ' A' ' 697' ' ' LEU . 11.2 ptt180 -51.5 -48.22 62.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.915 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.646 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.0 mtt -56.08 -47.58 77.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.906 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -52.59 -45.62 66.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.912 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -58.28 -62.35 1.9 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.926 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.49 ' CE2' HD11 ' A' ' 670' ' ' LEU . 22.9 t80 -45.1 -55.61 5.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.892 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -54.74 -48.11 72.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.882 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -47.84 -41.58 24.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.405 ' O ' ' C ' ' A' ' 670' ' ' LEU . 5.5 mtm -67.53 -63.96 0.95 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.883 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.49 HD11 ' CE2' ' A' ' 666' ' ' PHE . 44.6 mt -38.01 -34.85 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.916 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 15.9 tp -83.25 -56.03 4.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -54.71 -64.32 0.87 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.904 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . 0.405 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 2.5 mmp_? -44.38 -29.68 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.897 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 90.29 33.22 8.88 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.473 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.798 HG13 ' CD ' ' A' ' 684' ' ' GLU . 43.1 t -56.9 116.29 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 0.0 111.135 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 58.1 m -75.3 144.92 42.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.888 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . 0.425 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -82.68 -28.98 30.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.076 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -77.33 -2.06 33.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.853 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.2 m -90.57 -177.84 5.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.862 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 65.8 p -104.46 160.88 14.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.183 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.62 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 29.7 t-105 -64.75 -27.08 68.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.882 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -61.47 -58.83 6.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.868 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.44 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 17.0 mttm -55.73 -58.98 5.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.91 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.798 ' CD ' HG13 ' A' ' 675' ' ' VAL . 38.1 mm-40 -56.19 -44.85 79.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.869 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.62 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 6.4 tp -46.55 -62.26 1.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.929 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.493 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.5 p-80 -58.63 -30.62 67.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.868 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 43.5 mttm -69.34 -20.99 63.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 30.0 pt -122.68 8.31 5.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.189 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.493 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -77.7 -29.0 15.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.156 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.462 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 12.0 p90 -70.56 -44.43 67.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.915 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.462 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.6 t70 -53.22 139.76 45.19 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.573 0.702 . . . . 0.0 110.911 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.3 Cg_endo -69.67 -34.29 15.19 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.713 2.275 . . . . 0.0 112.369 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.588 ' HA ' HD12 ' A' ' 696' ' ' LEU . 16.5 mtm-85 -56.63 -24.39 47.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.874 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.45 ' CZ ' ' HD2' ' A' ' 702' ' ' ARG . 22.0 t80 -65.92 -17.88 64.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.888 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 15.8 mt -107.19 23.13 14.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 693' ' ' ARG . 78.5 mt -104.22 -29.5 10.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.89 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.802 HD21 ' HG3' ' A' ' 662' ' ' ARG . 26.7 mt -102.84 151.22 22.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.897 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 23.4 m-20 -50.74 161.85 0.62 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.635 0.731 . . . . 0.0 110.892 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . 0.403 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 54.1 Cg_endo -69.74 -37.1 9.69 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.725 2.283 . . . . 0.0 112.347 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -72.19 -39.28 68.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.916 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.451 ' O ' ' C ' ' A' ' 702' ' ' ARG . 35.7 mm-40 -59.88 -53.94 51.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.904 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.451 ' C ' ' O ' ' A' ' 701' ' ' GLU . 29.0 mtm105 -34.1 -48.03 0.3 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.914 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 16.5 tptt -72.35 -43.74 63.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.953 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' A' ' 701' ' ' GLU . 29.1 mt-30 -57.28 -56.92 15.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.908 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.72 -48.59 88.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.148 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.633 ' O ' HG23 ' A' ' 710' ' ' VAL . 52.7 t80 -57.2 -36.73 71.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.863 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -64.87 -51.5 61.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.864 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . 0.48 ' O ' HG23 ' A' ' 712' ' ' THR . 87.8 mm-40 -58.2 -36.34 72.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -67.18 -41.48 85.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.974 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 706' ' ' PHE . 96.7 t -69.42 -39.3 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.151 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 17.1 tttm -62.99 -40.58 98.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 708' ' ' GLN . 73.0 p -75.13 -38.59 61.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.13 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 5.8 mmm180 -60.23 -36.29 77.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.111 179.907 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.529 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.1 Cg_endo . . . . . 0 C--O 1.232 0.222 0 CA-C-O 120.872 0.28 . . . . 0.0 112.289 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.425 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 15.2 tp -49.93 -49.74 48.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.87 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -54.35 -41.16 68.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.918 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.529 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -62.31 -70.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.091 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.644 ' HG3' HD21 ' A' ' 697' ' ' LEU . 7.6 ptt180 -48.46 -46.76 38.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.878 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.3 mtt -57.5 -46.53 83.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.846 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 3.7 mmmm -53.43 -45.83 69.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.887 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -58.16 -60.91 3.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.897 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.639 ' HB2' HD12 ' A' ' 697' ' ' LEU . 18.0 t80 -48.72 -58.74 4.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.922 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.698 ' HA ' HD12 ' A' ' 670' ' ' LEU . 51.5 tttt -51.84 -37.45 52.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.919 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -58.71 -54.18 49.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.896 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.531 ' CE ' ' CE1' ' A' ' 666' ' ' PHE . 2.7 ptt? -65.42 -37.07 85.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.908 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.698 HD12 ' HA ' ' A' ' 667' ' ' LYS . 30.0 mt -52.0 -50.62 60.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 37.7 tp -74.74 -47.36 31.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -56.74 -66.08 0.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.906 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -42.64 -25.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.853 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 85.98 44.34 6.04 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.479 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.558 HG13 ' CG ' ' A' ' 684' ' ' GLU . 25.8 t -68.37 109.62 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.784 0.326 . . . . 0.0 111.1 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 24.5 m -67.51 136.45 54.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.831 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . 0.673 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -69.58 -55.74 9.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.125 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -54.27 -30.81 51.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.852 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.9 m -55.83 167.14 0.61 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.863 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 44.8 p -93.88 153.45 18.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.154 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 33.9 t-105 -57.47 -26.1 60.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.933 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.25 -60.24 3.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.881 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -54.03 -59.07 5.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.87 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.558 ' CG ' HG13 ' A' ' 675' ' ' VAL . 59.6 mm-40 -54.39 -43.98 71.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 7.0 tp -48.23 -57.63 5.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.605 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.5 p-80 -59.29 -33.74 71.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.839 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.475 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 24.5 mttp -65.29 -26.08 67.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 16.4 pt -117.29 7.87 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.153 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.605 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -76.88 -35.91 24.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.11 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.451 ' CE1' ' O ' ' A' ' 687' ' ' LYS . 47.9 p90 -83.41 13.84 4.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 693' ' ' ARG . 2.9 t70 -102.46 143.61 26.95 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.614 0.721 . . . . 0.0 110.843 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.409 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.74 -46.81 1.1 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.688 2.259 . . . . 0.0 112.332 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.514 ' HA ' HD12 ' A' ' 696' ' ' LEU . 54.8 mtm180 -53.96 -26.06 23.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.607 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 0.7 OUTLIER -66.48 -27.92 68.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.938 -179.858 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.9 mt -89.0 2.85 53.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.964 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 693' ' ' ARG . 94.8 mt -86.98 -42.22 13.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.912 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.644 HD21 ' HG3' ' A' ' 662' ' ' ARG . 29.7 mt -91.17 144.46 25.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.891 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -51.41 161.85 0.75 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.58 0.705 . . . . 0.0 110.923 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -35.1 13.31 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.682 2.255 . . . . 0.0 112.34 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -72.09 -45.95 58.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -59.38 -45.55 91.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.839 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.607 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 42.0 mtt180 -43.45 -45.14 6.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.822 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.11 -44.68 62.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.875 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -57.6 -60.0 4.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.93 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 72.2 t -55.21 -47.12 77.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.159 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.577 ' O ' HG23 ' A' ' 710' ' ' VAL . 37.2 t80 -56.59 -41.25 76.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.897 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -59.12 -49.54 77.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.848 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -62.04 -42.63 99.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.93 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.586 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 7.0 t80 -58.75 -37.67 76.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.958 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.673 HG13 ' HB1' ' A' ' 677' ' ' ALA . 96.8 t -69.88 -45.89 75.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.162 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 26.9 tttm -51.95 -51.94 53.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.903 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 3.9 p -68.81 -31.1 69.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.175 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.586 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 3.2 mmm180 -65.96 -33.76 76.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.924 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.138 179.879 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.539 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.3 Cg_endo . . . . . 0 C--O 1.232 0.19 0 CA-C-O 120.856 0.273 . . . . 0.0 112.352 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.429 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 13.2 tp -49.25 -44.51 43.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -58.95 -42.26 89.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.539 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -61.0 -65.06 0.75 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.065 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.475 ' HG3' HD21 ' A' ' 697' ' ' LEU . 10.3 ptt180 -53.18 -54.33 37.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.904 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.521 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.7 mtt -51.47 -46.06 62.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.846 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.4 -43.4 71.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -59.55 -58.76 7.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.894 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.685 ' HB2' HD12 ' A' ' 697' ' ' LEU . 26.9 t80 -50.64 -51.31 50.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.89 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.434 ' HA ' HD12 ' A' ' 670' ' ' LEU . 27.4 tttt -60.89 -35.35 76.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.927 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -61.8 -56.61 17.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -59.87 -36.24 76.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.887 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.564 HD11 ' CE2' ' A' ' 666' ' ' PHE . 34.6 mt -56.95 -48.59 77.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.906 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.77 -45.23 62.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' A' ' 674' ' ' GLY . 23.2 mt-10 -61.67 -65.81 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -41.5 -24.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 86.71 46.86 5.02 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.452 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.44 HG13 ' CG ' ' A' ' 684' ' ' GLU . 24.4 t -72.22 106.4 2.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.829 0.347 . . . . 0.0 111.13 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 9.3 t -65.59 140.02 58.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.866 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . 0.4 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -78.75 -44.07 24.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.072 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -63.78 -20.89 66.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.4 m -69.04 -175.52 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.868 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . 0.404 HG23 ' H ' ' A' ' 683' ' ' LYS . 12.5 t -106.61 167.24 9.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.136 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.498 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 31.4 t-105 -69.13 -26.8 65.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.866 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -61.2 -63.01 1.43 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.875 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.404 ' H ' HG23 ' A' ' 680' ' ' THR . 5.9 mtpm? -52.67 -59.03 4.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.44 ' CG ' HG13 ' A' ' 675' ' ' VAL . 49.1 mm-40 -55.51 -44.54 76.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.498 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.3 tp -47.79 -55.99 8.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.914 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.55 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.8 p-80 -61.9 -31.82 72.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.469 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 82.5 mttt -66.66 -24.91 66.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.918 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 20.9 pt -120.68 9.01 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.103 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.55 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.0 p -75.22 -26.69 18.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.175 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -84.65 -39.05 19.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.877 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.423 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 8.6 t70 -43.59 139.78 2.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.655 0.741 . . . . 0.0 110.867 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.82 -36.28 10.94 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.638 2.225 . . . . 0.0 112.357 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.644 ' HA ' HD12 ' A' ' 696' ' ' LEU . 57.0 mtm180 -65.16 -20.07 66.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.856 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.59 ' CE2' ' HD2' ' A' ' 702' ' ' ARG . 0.6 OUTLIER -66.03 -21.29 66.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.926 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 52.1 mt -93.89 -13.76 26.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.905 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.644 HD12 ' HA ' ' A' ' 693' ' ' ARG . 63.7 mt -67.47 -52.05 43.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.685 HD12 ' HB2' ' A' ' 666' ' ' PHE . 33.3 mt -79.72 147.23 32.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.91 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -51.51 162.54 0.69 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.627 0.727 . . . . 0.0 110.89 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . 0.402 ' HA ' ' CZ ' ' A' ' 702' ' ' ARG . 53.5 Cg_endo -69.75 -36.61 10.51 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.683 2.255 . . . . 0.0 112.335 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -72.19 -41.68 66.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 15.7 mt-10 -58.68 -51.22 70.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.59 ' HD2' ' CE2' ' A' ' 694' ' ' TYR . 24.7 mtm105 -34.23 -50.88 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.849 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -70.56 -46.2 63.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -55.47 -61.16 2.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.926 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 65.9 t -54.06 -45.19 65.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.086 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.68 -52.42 63.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.866 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -51.13 -47.19 62.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -63.4 -39.82 95.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.57 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 20.3 t80 -63.69 -49.63 72.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.921 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.4 HG13 ' HB1' ' A' ' 677' ' ' ALA . 82.4 t -55.93 -42.49 71.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.128 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -60.3 -46.17 90.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.899 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 15.8 p -65.8 -37.33 86.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.119 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.57 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.3 mmm180 -67.04 -28.73 68.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.104 179.964 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.556 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.9 Cg_endo . . . . . 0 C--O 1.232 0.199 0 CA-C-O 120.811 0.255 . . . . 0.0 112.34 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 31.4 tp -54.69 -51.11 66.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.933 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 12.0 mm-40 -55.64 -30.5 61.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.92 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.556 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -71.84 -70.99 0.3 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.126 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.75 ' CZ ' HD23 ' A' ' 697' ' ' LEU . 0.1 OUTLIER -48.35 -52.69 20.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.897 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.606 ' HA ' HD11 ' A' ' 697' ' ' LEU . 6.0 mtt -54.84 -48.48 72.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . 0.467 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 1.7 mmmm -53.16 -37.45 61.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.916 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -64.01 -56.42 15.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.906 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.65 ' HB2' HD12 ' A' ' 697' ' ' LEU . 29.4 t80 -52.31 -47.61 65.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.504 ' HA ' HD12 ' A' ' 670' ' ' LEU . 41.3 tttt -67.26 -34.26 77.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.92 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -62.99 -44.76 95.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.877 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.431 ' O ' ' CG ' ' A' ' 673' ' ' ARG . 2.8 ptt? -70.35 -32.36 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 667' ' ' LYS . 40.8 mt -60.85 -49.82 75.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.892 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.5 tp -70.89 -55.91 7.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.942 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . 0.405 ' C ' ' N ' ' A' ' 674' ' ' GLY . 15.9 mt-10 -49.31 -63.58 1.06 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . 0.431 ' CG ' ' O ' ' A' ' 669' ' ' MET . 4.6 mmp_? -45.67 -21.31 0.11 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.843 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . 0.405 ' N ' ' C ' ' A' ' 672' ' ' GLU . . . 85.7 46.02 5.57 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.486 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.881 HG13 ' CD ' ' A' ' 684' ' ' GLU . 70.9 t -78.32 103.56 5.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 111.142 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 16.4 m -67.7 158.51 32.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.871 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . 0.445 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -88.57 -36.81 16.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.072 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -66.55 -10.08 41.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.919 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.1 m -82.7 175.49 10.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.822 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 59.4 p -102.44 178.33 4.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.172 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.462 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 50.6 t-105 -76.08 -25.22 55.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.933 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -67.15 -56.76 8.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.883 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.498 ' O ' ' CD2' ' A' ' 686' ' ' HIS . 59.6 mttm -53.94 -59.03 5.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.875 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.881 ' CD ' HG13 ' A' ' 675' ' ' VAL . 64.0 mm-40 -57.77 -45.8 85.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.462 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 7.9 tp -45.27 -53.38 8.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.921 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.645 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.7 p80 -68.41 -28.65 67.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.897 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.562 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 37.9 mttm -68.96 -21.12 64.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 26.1 pt -121.96 -0.38 7.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.115 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 686' ' ' HIS . 8.7 p -62.82 -25.32 38.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.13 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.562 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 18.6 p90 -93.59 11.66 28.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.835 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.429 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.5 t70 -99.3 139.85 21.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.596 0.712 . . . . 0.0 110.877 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.78 -31.78 19.78 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.688 2.259 . . . . 0.0 112.302 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 22.4 mtm-85 -67.21 -21.49 65.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.841 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.473 ' CD1' ' O ' ' A' ' 694' ' ' TYR . 10.6 t80 -68.55 -5.53 20.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.1 mt -120.91 14.8 11.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.944 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 55.5 mt -95.51 -26.18 15.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.939 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.75 HD23 ' CZ ' ' A' ' 662' ' ' ARG . 29.8 mt -112.12 155.56 23.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . 0.422 ' HB3' ' HD2' ' A' ' 699' ' ' PRO . 0.2 OUTLIER -54.47 158.52 4.02 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.603 0.716 . . . . 0.0 110.884 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 698' ' ' ASN . 53.2 Cg_endo -69.82 -33.73 15.77 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.626 2.217 . . . . 0.0 112.345 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -72.69 -46.01 55.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.945 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' A' ' 704' ' ' GLN . 0.4 OUTLIER -62.35 -54.52 39.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.877 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.528 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 57.0 mtm180 -34.21 -48.29 0.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.902 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.57 -41.34 69.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.901 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 701' ' ' GLU . 21.5 mm-40 -60.39 -56.63 19.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 33.2 t -57.31 -43.25 81.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.116 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.495 ' O ' HG23 ' A' ' 710' ' ' VAL . 21.8 t80 -62.17 -37.93 87.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.891 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -60.86 -49.86 75.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.863 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -61.44 -35.34 77.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.539 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 0.8 OUTLIER -65.65 -35.98 82.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.954 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 706' ' ' PHE . 93.5 t -70.95 -51.3 36.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.135 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 12.9 ttmt -56.8 -35.81 69.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.918 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 15.6 p -75.1 -39.78 60.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.184 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.539 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 2.4 mmp_? -64.32 -35.66 81.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.85 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.112 179.918 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.232 0.187 0 CA-C-O 120.815 0.256 . . . . 0.0 112.338 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.43 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 18.6 tp -48.05 -49.05 32.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -55.53 -41.13 72.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -61.47 -67.64 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.727 ' HG3' HD21 ' A' ' 697' ' ' LEU . 7.9 ptt180 -51.14 -46.4 61.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.869 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.58 ' HA ' HD11 ' A' ' 697' ' ' LEU . 6.7 mtt -58.83 -49.47 77.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.895 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 16.3 mtmt -49.62 -46.24 49.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . 0.471 ' OE1' ' CD1' ' A' ' 696' ' ' LEU . 86.4 mt-30 -59.33 -64.1 1.06 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.885 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.736 ' HB2' HD12 ' A' ' 697' ' ' LEU . 27.6 t80 -41.52 -56.95 2.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.88 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 35.1 tttp -54.94 -47.41 74.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -50.59 -33.17 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.854 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.423 ' O ' ' C ' ' A' ' 670' ' ' LEU . 5.4 mtm -74.58 -65.79 0.82 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' A' ' 669' ' ' MET . 83.6 mt -35.3 -40.91 0.15 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.89 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.9 tp -76.67 -58.15 3.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.934 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 674' ' ' GLY . 8.3 mm-40 -57.78 -64.3 0.95 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . 0.434 ' C ' ' O ' ' A' ' 672' ' ' GLU . 4.2 mmp_? -35.02 -34.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.873 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 98.03 42.27 3.09 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.419 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.631 HG13 ' HG3' ' A' ' 684' ' ' GLU . 94.9 t -75.56 136.94 23.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.844 0.354 . . . . 0.0 111.156 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 15.9 m -103.7 121.89 43.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.841 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . 0.526 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -45.98 -57.88 4.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.121 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -46.46 -30.24 2.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.902 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.87 160.72 11.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.854 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . 0.517 HG23 ' H ' ' A' ' 683' ' ' LYS . 14.4 t -82.33 -177.74 6.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.146 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.558 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 19.3 t-105 -84.3 -34.52 23.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.938 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -64.32 -59.86 3.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.517 ' H ' HG23 ' A' ' 680' ' ' THR . 12.4 mtpt -46.25 -58.94 3.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.915 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.631 ' HG3' HG13 ' A' ' 675' ' ' VAL . 31.9 mm-40 -62.64 -47.58 83.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.852 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.558 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 7.3 tp -43.16 -48.54 6.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.92 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.693 ' O ' HG12 ' A' ' 689' ' ' VAL . 0.9 OUTLIER -70.42 -38.43 74.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.85 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.517 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 44.3 mttp -60.56 -19.56 57.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.835 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 19.5 pt -115.39 -16.78 8.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.147 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -55.26 -32.41 28.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.143 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -62.74 -36.41 82.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.861 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.425 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 8.5 t70 -64.0 139.74 97.73 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.609 0.719 . . . . 0.0 110.848 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.8 -36.92 9.82 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.708 2.272 . . . . 0.0 112.315 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.47 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 22.3 mtm-85 -56.39 -19.72 16.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.852 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.614 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 27.5 t80 -66.76 -18.5 65.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.894 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 20.1 mt -96.3 -3.85 43.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.471 ' CD1' ' OE1' ' A' ' 665' ' ' GLN . 83.0 mt -77.09 -43.72 33.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.911 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.736 HD12 ' HB2' ' A' ' 666' ' ' PHE . 31.9 mt -89.88 152.24 21.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.904 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 24.2 m-20 -61.84 162.1 18.56 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.663 0.744 . . . . 0.0 110.849 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . 0.422 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.4 Cg_endo -69.7 -34.06 15.57 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.694 2.262 . . . . 0.0 112.364 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 29.3 mttm -72.13 -47.07 53.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 24.4 mt-10 -60.75 -56.53 20.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.903 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.614 ' NH1' ' CE2' ' A' ' 694' ' ' TYR . 46.0 mtm180 -34.59 -45.41 0.24 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.849 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.34 -45.76 62.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . 0.435 ' N ' ' O ' ' A' ' 701' ' ' GLU . 11.2 mm100 -57.12 -50.35 73.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.914 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.64 -39.24 83.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.11 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.831 ' O ' HG23 ' A' ' 710' ' ' VAL . 24.4 t80 -65.22 -36.84 85.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.859 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -64.68 -52.39 57.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.88 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . 0.466 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 5.5 pt20 -60.67 -36.65 79.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.913 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.488 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 11.7 t80 -66.76 -39.5 87.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.924 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 706' ' ' PHE . 99.6 t -64.55 -45.63 95.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.196 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 711' ' ' LYS . 0.9 OUTLIER -59.38 -52.22 66.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.9 179.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 18.4 p -60.16 -37.79 81.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.157 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.488 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 3.4 mmp_? -65.11 -38.28 90.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.902 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.142 179.882 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.821 0.259 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 25.3 tp -51.14 -48.57 61.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.938 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . 0.485 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 14.1 pt-20 -56.03 -36.19 67.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.87 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.41 -71.07 0.22 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.148 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.454 ' HE ' HD23 ' A' ' 697' ' ' LEU . 3.3 ptm180 -46.53 -56.98 5.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.464 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.9 mtt -50.69 -49.8 56.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.902 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . 0.485 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 2.5 mmmm -51.74 -41.09 61.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.91 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -60.8 -56.46 20.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.883 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.635 ' HB2' HD12 ' A' ' 697' ' ' LEU . 24.8 t80 -51.73 -55.55 19.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.83 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -54.89 -35.86 64.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.928 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -60.14 -47.58 85.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.856 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.526 ' CE ' ' CE1' ' A' ' 666' ' ' PHE . 2.9 ptt? -72.75 -36.4 67.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.894 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.533 HD11 ' CE2' ' A' ' 666' ' ' PHE . 33.1 mt -52.42 -51.19 60.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.965 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 23.3 tp -76.96 -53.62 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.939 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -49.64 -61.44 2.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.874 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 15.6 mmp_? -49.42 -19.57 0.56 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 82.09 44.34 7.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.45 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.44 HG13 ' CG ' ' A' ' 684' ' ' GLU . 71.7 t -70.13 103.54 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.839 0.352 . . . . 0.0 111.136 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 19.4 t -63.0 145.54 55.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.824 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . 0.487 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -81.58 -36.85 28.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.1 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -72.75 -9.11 58.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.865 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.1 m -80.94 168.13 19.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.885 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 15.2 t -95.81 173.62 7.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.182 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.467 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 57.0 t-105 -70.64 -30.82 67.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.876 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -59.79 -59.16 5.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.574 ' HA ' ' CD2' ' A' ' 686' ' ' HIS . 38.5 mttm -56.78 -59.01 5.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.44 ' CG ' HG13 ' A' ' 675' ' ' VAL . 56.5 mm-40 -55.51 -39.27 70.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.872 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.467 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 8.0 tp -53.37 -59.6 4.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.868 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.713 ' O ' HG12 ' A' ' 689' ' ' VAL . 2.0 p80 -60.02 -27.6 67.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.879 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.556 ' HG3' ' CE1' ' A' ' 686' ' ' HIS . 47.6 mttm -69.25 -34.18 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.877 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 7.5 pt -111.26 9.66 8.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.125 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 686' ' ' HIS . 9.8 p -70.25 -32.71 51.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.117 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 5.2 p90 -77.1 -38.49 52.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.864 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.447 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 9.1 t70 -50.94 139.76 21.96 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.559 0.695 . . . . 0.0 110.887 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.2 Cg_endo -69.76 -37.82 8.64 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.693 2.262 . . . . 0.0 112.329 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.476 ' HA ' HD12 ' A' ' 696' ' ' LEU . 14.4 mtm-85 -58.87 -20.98 56.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.88 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.438 ' OH ' ' CD1' ' A' ' 685' ' ' LEU . 61.8 t80 -69.2 -7.76 39.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.912 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 33.2 mt -119.07 20.48 12.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.476 HD12 ' HA ' ' A' ' 693' ' ' ARG . 96.7 mt -104.57 -34.98 8.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.934 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.635 HD12 ' HB2' ' A' ' 666' ' ' PHE . 29.1 mt -101.55 144.34 30.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.92 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -48.7 161.88 0.39 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.659 0.742 . . . . 0.0 110.842 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . 0.414 ' HA ' ' NE ' ' A' ' 702' ' ' ARG . 54.3 Cg_endo -69.7 -33.88 15.89 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.693 2.262 . . . . 0.0 112.358 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 3.9 mptt -72.15 -44.96 62.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.836 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.508 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -61.28 -50.74 71.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.895 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.414 ' NE ' ' HA ' ' A' ' 699' ' ' PRO . 53.8 mtm180 -39.97 -45.28 1.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . 0.403 ' HD2' ' C ' ' A' ' 703' ' ' LYS . 2.0 tmmm? -71.68 -43.89 65.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.857 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -58.62 -58.17 9.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.0 t -57.56 -40.66 76.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.107 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.893 ' O ' HG23 ' A' ' 710' ' ' VAL . 18.5 t80 -66.78 -30.66 70.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.922 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . 0.428 ' C ' ' OD1' ' A' ' 707' ' ' ASP . 0.8 OUTLIER -66.44 -55.28 16.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.864 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . 0.401 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 7.0 pt20 -57.9 -41.72 83.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.936 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.546 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 0.8 OUTLIER -60.2 -41.01 92.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.953 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 706' ' ' PHE . 92.8 t -63.56 -50.42 78.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.085 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -51.14 -51.62 51.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.907 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 2.3 p -60.18 -40.47 90.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.122 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.546 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 2.6 mmp_? -66.16 -26.96 67.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.842 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.094 179.954 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.0 Cg_endo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.83 0.263 . . . . 0.0 112.333 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 23.7 tp -56.19 -48.71 75.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . 0.462 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 29.3 mt-10 -56.05 -32.64 64.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.848 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.433 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -69.97 -69.98 0.32 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.135 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.616 ' HG3' HD21 ' A' ' 697' ' ' LEU . 5.6 ptm180 -45.56 -48.09 14.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.855 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.701 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.5 mtt -56.39 -54.02 50.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . 0.462 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 3.3 mmpt? -48.37 -46.49 36.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -55.62 -63.37 1.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.734 ' HB2' HD12 ' A' ' 697' ' ' LEU . 22.8 t80 -45.38 -52.43 9.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.922 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -58.35 -44.22 88.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.861 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -51.47 -39.75 58.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.829 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 16.3 mtm -68.73 -58.6 3.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 52.6 mt -43.11 -38.37 2.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.911 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 15.4 tp -80.41 -58.88 2.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -52.85 -64.36 0.84 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.904 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -46.3 -25.76 0.69 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.821 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 85.78 31.07 22.04 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.468 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.572 HG13 ' CD ' ' A' ' 684' ' ' GLU . 24.4 t -53.84 108.74 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.857 0.36 . . . . 0.0 111.142 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 8.3 t -64.55 149.71 48.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.87 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . 0.486 ' HA ' HG13 ' A' ' 710' ' ' VAL . . . -82.56 -39.82 21.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.118 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -66.53 -24.69 66.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.858 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.8 m -63.66 171.0 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.884 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . 0.625 HG22 ' HE3' ' A' ' 683' ' ' LYS . 10.8 t -100.25 166.07 11.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 52.6 t-105 -63.53 -33.32 75.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.897 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -58.79 -56.11 26.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.88 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.625 ' HE3' HG22 ' A' ' 680' ' ' THR . 26.6 mtmt -57.7 -59.08 5.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.881 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.572 ' CD ' HG13 ' A' ' 675' ' ' VAL . 56.1 mm-40 -55.99 -37.67 69.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.894 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 18.0 tp -53.75 -58.79 5.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.667 ' O ' HG12 ' A' ' 689' ' ' VAL . 2.5 p-80 -59.4 -32.03 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.822 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.549 ' O ' ' CE2' ' A' ' 690' ' ' PHE . 40.9 mttm -66.17 -29.03 69.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.868 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 20.1 pt -114.75 8.16 7.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.141 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.667 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.0 p -75.37 -34.53 30.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.127 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.549 ' CE2' ' O ' ' A' ' 687' ' ' LYS . 51.3 p90 -81.85 12.67 3.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.896 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.426 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 11.2 t70 -101.23 139.9 20.83 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.581 0.705 . . . . 0.0 110.849 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.72 -40.07 5.82 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.676 2.251 . . . . 0.0 112.347 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.434 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 16.1 mtm-85 -61.43 -30.96 70.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.836 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.455 ' CE1' ' HD3' ' A' ' 702' ' ' ARG . 41.2 t80 -59.91 -12.93 8.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.911 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.413 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 28.4 mt -108.58 19.76 19.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.911 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.434 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 97.6 mt -101.73 -48.59 4.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.876 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.734 HD12 ' HB2' ' A' ' 666' ' ' PHE . 29.0 mt -82.71 146.84 28.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.902 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -49.95 161.65 0.54 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.642 0.734 . . . . 0.0 110.92 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -34.31 14.96 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.723 2.282 . . . . 0.0 112.356 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -72.09 -45.23 61.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.897 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 702' ' ' ARG . 67.7 mm-40 -58.6 -50.77 72.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.9 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.455 ' HD3' ' CE1' ' A' ' 694' ' ' TYR . 68.7 mtt180 -35.82 -49.24 0.6 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.892 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 10.8 tptp -71.76 -44.83 63.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.854 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -57.46 -62.25 1.91 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.929 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 66.7 t -53.77 -48.43 61.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.17 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.672 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 23.8 t80 -61.07 -37.46 82.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -57.27 -50.86 71.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.919 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -61.38 -40.5 94.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.566 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 4.2 t80 -63.52 -40.93 98.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.908 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.672 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 85.4 t -67.03 -53.61 32.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.153 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 13.6 mtpp -48.69 -53.55 18.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.852 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 1.1 p -61.27 -41.44 96.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.119 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.566 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 12.7 mmm180 -64.23 -25.79 68.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.869 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.09 179.912 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.52 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo . . . . . 0 C--O 1.232 0.197 0 CA-C-O 120.786 0.244 . . . . 0.0 112.359 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 41.2 tp -49.26 -49.21 44.48 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.897 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -51.83 -39.69 59.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.878 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.52 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -66.59 -70.29 0.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.116 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -44.05 -43.34 6.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.875 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.623 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.6 mtt -65.29 -40.32 93.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.86 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 17.3 mmmt -59.55 -41.41 90.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -65.16 -63.6 1.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.936 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.738 ' HB2' HD12 ' A' ' 697' ' ' LEU . 25.8 t80 -39.94 -57.2 1.66 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.861 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -54.64 -48.35 72.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.924 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -49.98 -35.39 24.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.848 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.427 ' O ' ' N ' ' A' ' 672' ' ' GLU . 4.7 mtm -71.84 -65.32 0.78 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.454 HD11 ' CE2' ' A' ' 666' ' ' PHE . 49.7 mt -36.83 -38.94 0.19 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.912 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 12.6 tp -75.51 -44.68 42.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . 0.427 ' N ' ' O ' ' A' ' 669' ' ' MET . 11.5 mm-40 -72.87 -64.55 0.94 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.892 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . 0.429 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 12.5 mmp_? -39.16 -35.68 0.25 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.847 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 98.66 28.67 7.78 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.46 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.569 HG13 ' CG ' ' A' ' 684' ' ' GLU . 38.0 t -59.43 91.78 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.847 0.356 . . . . 0.0 111.135 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 73.7 m -49.11 151.16 1.4 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.821 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -84.69 -48.11 9.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.127 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -56.36 -31.26 63.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.865 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -60.28 -178.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.889 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 10.9 t -104.45 -177.3 3.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.146 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.492 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 45.9 t-105 -83.05 -29.5 28.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.891 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -60.88 -60.79 3.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.881 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -54.15 -58.99 5.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.948 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.569 ' CG ' HG13 ' A' ' 675' ' ' VAL . 23.9 mm-40 -56.44 -42.51 78.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.895 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.492 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 7.7 tp -48.49 -54.92 12.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.985 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.631 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.8 p-80 -63.67 -32.69 74.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 40.2 mttm -66.41 -23.22 66.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 22.4 pt -120.08 5.76 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.147 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.631 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.3 p -73.0 -25.24 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.117 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.577 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 13.1 p90 -76.25 -52.37 10.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.863 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.577 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.0 t70 -37.14 139.84 0.48 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.577 0.703 . . . . 0.0 110.862 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.5 Cg_endo -69.8 -36.49 10.61 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.631 2.22 . . . . 0.0 112.326 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.47 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 69.3 mtm180 -63.86 -19.44 65.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.53 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 27.7 t80 -66.07 -15.14 62.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.947 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 14.1 mt -101.47 3.71 40.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.897 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.47 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 80.3 mt -83.71 -49.58 8.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.885 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.738 HD12 ' HB2' ' A' ' 666' ' ' PHE . 30.7 mt -83.81 143.91 29.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -52.11 162.33 0.85 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.651 0.739 . . . . 0.0 110.873 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . 0.41 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.7 Cg_endo -69.79 -35.42 12.59 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.674 2.249 . . . . 0.0 112.349 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 35.5 mttm -72.16 -46.3 56.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.877 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -59.7 -51.2 70.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.541 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 47.3 mtm180 -40.09 -46.92 2.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.908 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -68.15 -45.89 72.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.884 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -58.04 -58.47 8.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 97.6 t -55.06 -37.47 42.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.121 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.682 ' O ' HG23 ' A' ' 710' ' ' VAL . 16.3 t80 -69.0 -32.13 71.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.844 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -68.58 -47.21 67.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.829 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . 0.403 ' HG2' ' N ' ' A' ' 709' ' ' TYR . 4.0 pt20 -68.17 -36.89 80.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.945 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.481 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 3.7 t80 -66.26 -41.02 90.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.931 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.682 HG23 ' O ' ' A' ' 706' ' ' PHE . 57.7 t -65.55 -45.51 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.138 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 6.8 ttmm -57.97 -51.24 70.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.903 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.7 p -61.39 -38.16 86.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.133 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.481 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 9.4 mmp_? -65.26 -33.65 76.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.888 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.15 179.864 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.514 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.163 0 CA-C-O 120.818 0.257 . . . . 0.0 112.317 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.412 HD12 ' HE ' ' A' ' 662' ' ' ARG . 13.8 tp -57.88 -53.43 58.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -51.84 -35.52 44.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.904 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.514 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -64.86 -68.01 0.39 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.114 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.785 ' HG3' HD21 ' A' ' 697' ' ' LEU . 14.3 ptt180 -52.12 -41.72 62.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.885 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.612 ' HA ' HD11 ' A' ' 697' ' ' LEU . 6.7 mtt -61.76 -43.27 99.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . 0.432 ' HA ' ' CE ' ' A' ' 664' ' ' LYS . 0.4 OUTLIER -58.44 -41.66 85.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.928 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . 0.568 ' OE1' HD13 ' A' ' 696' ' ' LEU . 81.5 mt-30 -61.23 -54.0 49.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.962 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.692 ' HB2' HD12 ' A' ' 697' ' ' LEU . 23.2 t80 -56.07 -45.19 79.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 6.0 ttpt -66.84 -36.47 82.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.919 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -60.33 -46.91 88.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.849 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.407 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 2.8 ptt? -69.2 -36.84 77.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.539 HD23 HG21 ' A' ' 675' ' ' VAL . 36.2 mt -56.4 -44.28 80.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.926 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 54.0 tp -76.34 -54.71 6.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.86 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.08 -61.9 1.95 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -48.07 -19.51 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.904 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 81.83 41.17 9.88 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.473 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.658 HG13 ' CG ' ' A' ' 684' ' ' GLU . 77.1 t -65.1 100.81 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.854 0.359 . . . . 0.0 111.151 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 58.2 m -52.22 148.07 6.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.873 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . 0.54 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -84.04 -39.34 19.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.126 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -82.69 43.91 0.87 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.8 m -130.86 -175.8 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.844 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . 0.415 HG23 ' H ' ' A' ' 683' ' ' LYS . 3.3 t -109.72 162.74 14.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.12 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.495 ' CH2' ' HB3' ' A' ' 702' ' ' ARG . 35.1 t-105 -65.37 -27.31 68.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.941 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -59.44 -60.17 4.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.924 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.415 ' H ' HG23 ' A' ' 680' ' ' THR . 22.6 mtpt -55.23 -59.0 5.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.658 ' CG ' HG13 ' A' ' 675' ' ' VAL . 49.9 mm-40 -54.8 -41.9 71.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.868 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.1 tp -50.66 -55.22 17.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.841 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.1 p-80 -60.05 -35.03 74.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.844 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.544 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 22.2 mttp -67.53 -23.04 65.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.899 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 6.9 pt -116.73 6.47 7.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.072 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.841 HG12 ' O ' ' A' ' 686' ' ' HIS . 9.0 p -70.93 -24.69 24.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.111 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.527 ' C ' ' CD1' ' A' ' 690' ' ' PHE . 2.4 p90 -87.98 -13.25 42.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.885 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.431 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.6 t70 -77.4 139.87 64.33 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.643 0.735 . . . . 0.0 110.824 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.0 Cg_endo -69.76 -34.16 15.13 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.684 2.256 . . . . 0.0 112.336 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.548 ' HA ' HD12 ' A' ' 696' ' ' LEU . 82.0 mtm180 -65.83 -16.1 63.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.858 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.432 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 33.0 t80 -70.0 -7.69 42.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.918 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 15.1 mt -118.13 12.14 13.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.907 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.568 HD13 ' OE1' ' A' ' 665' ' ' GLN . 90.6 mt -93.59 -23.26 18.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.785 HD21 ' HG3' ' A' ' 662' ' ' ARG . 30.8 mt -114.83 144.93 42.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -50.06 162.05 0.52 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.635 0.731 . . . . 0.0 110.9 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -31.1 21.07 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.659 2.239 . . . . 0.0 112.345 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 37.3 mtpt -72.16 -45.46 60.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.441 ' OE1' ' CE ' ' A' ' 663' ' ' MET . 18.8 mm-40 -60.12 -52.95 63.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.878 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.519 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 10.4 mtp180 -35.3 -48.64 0.47 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.839 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.27 -47.26 62.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.928 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -56.66 -60.77 3.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 94.2 t -55.31 -38.88 49.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.137 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.426 ' O ' HG23 ' A' ' 710' ' ' VAL . 43.1 t80 -62.93 -37.26 86.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.851 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -64.76 -58.01 7.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.845 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . 0.477 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 10.4 pt20 -53.87 -37.02 63.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.925 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.477 ' N ' ' HG3' ' A' ' 708' ' ' GLN . 2.6 t80 -63.87 -43.3 96.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.54 HG13 ' HB1' ' A' ' 677' ' ' ALA . 69.6 t -67.65 -45.08 85.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.104 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -53.25 -48.96 67.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.903 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.99 -34.77 77.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.168 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -66.79 -24.44 66.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.901 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.071 179.928 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.446 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.6 Cg_endo . . . . . 0 C--O 1.232 0.203 0 CA-C-O 120.846 0.269 . . . . 0.0 112.336 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.407 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 15.7 tp -56.03 -48.08 76.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.927 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -54.69 -37.01 65.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.446 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -66.54 -69.78 0.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.05 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.412 ' HG3' HD21 ' A' ' 697' ' ' LEU . 6.8 ptt180 -49.35 -45.39 45.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.91 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.5 mtt -60.87 -45.09 95.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 1.3 mmmm -55.05 -44.03 74.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -60.48 -62.08 2.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.939 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.716 ' HB2' HD12 ' A' ' 697' ' ' LEU . 20.9 t80 -49.12 -53.02 22.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 35.0 tttt -54.6 -45.6 73.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -51.71 -44.52 63.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.89 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.4 ' O ' ' C ' ' A' ' 670' ' ' LEU . 8.4 mtm -62.3 -63.35 1.26 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.906 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 669' ' ' MET . 49.2 mt -38.49 -40.69 0.59 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 54.8 tp -75.9 -56.12 4.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . 0.475 ' O ' ' N ' ' A' ' 674' ' ' GLY . 8.2 mm-40 -59.23 -65.74 0.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . 0.41 ' HA ' ' NE ' ' A' ' 673' ' ' ARG . 14.1 mmp_? -39.22 -26.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.854 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . 0.475 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 86.44 34.61 11.71 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.503 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.738 HG13 ' HG3' ' A' ' 684' ' ' GLU . 76.7 t -60.29 99.07 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.868 0.366 . . . . 0.0 111.087 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 4.1 m -49.47 151.11 1.66 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -83.68 -26.69 29.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.103 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -102.01 48.12 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -123.97 -175.0 3.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.889 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 40.0 p -107.85 148.43 29.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.1 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 31.2 t-105 -59.56 -29.13 67.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -63.73 -53.69 47.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.831 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.519 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 10.8 mtpp -58.79 -59.06 6.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.738 ' HG3' HG13 ' A' ' 675' ' ' VAL . 64.6 mm-40 -55.32 -37.02 66.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 4.9 tp -54.53 -63.18 1.23 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.796 ' O ' HG12 ' A' ' 689' ' ' VAL . 5.6 p-80 -56.86 -29.26 62.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.809 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -68.13 -32.08 72.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.932 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 11.2 pt -112.78 9.94 8.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.108 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.796 HG12 ' O ' ' A' ' 686' ' ' HIS . 7.9 p -70.02 -24.66 26.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.131 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 10.4 p90 -80.08 -51.9 8.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.869 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.574 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 7.6 t70 -34.0 140.09 0.26 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.591 0.71 . . . . 0.0 110.904 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.67 -38.33 8.15 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.699 2.266 . . . . 0.0 112.357 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.468 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 28.7 mtm180 -65.56 -25.04 67.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.87 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.407 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 19.4 t80 -58.24 -11.59 2.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.897 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 30.9 mt -114.14 25.59 10.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.938 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.468 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 95.9 mt -109.52 -28.46 8.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.716 HD12 ' HB2' ' A' ' 666' ' ' PHE . 32.1 mt -103.21 139.37 38.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.971 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -48.5 162.62 0.35 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.598 0.713 . . . . 0.0 110.946 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -35.43 12.72 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.672 2.248 . . . . 0.0 112.348 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -72.15 -42.47 65.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.918 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 702' ' ' ARG . 26.4 mt-10 -60.0 -51.47 69.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.587 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 40.5 mtp180 -37.93 -51.04 1.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.871 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -66.09 -46.83 76.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.877 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -56.28 -61.06 2.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.882 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 84.6 t -56.19 -41.54 70.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.097 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.466 ' O ' HG23 ' A' ' 710' ' ' VAL . 21.9 t80 -60.32 -44.08 95.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -58.12 -48.07 81.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.853 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -61.11 -45.18 95.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.917 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.523 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 5.5 t80 -55.92 -44.95 78.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 706' ' ' PHE . 90.3 t -62.87 -51.91 65.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.134 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -45.98 -48.38 16.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.899 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.2 p -65.28 -46.54 80.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.145 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.523 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 12.5 mmp_? -59.22 -21.06 58.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.045 179.927 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.504 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.1 Cg_endo . . . . . 0 C--O 1.232 0.205 0 CA-C-O 120.818 0.258 . . . . 0.0 112.331 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 17.5 tp -57.81 -46.8 84.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -55.81 -32.17 63.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.92 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.504 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -70.84 -66.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.122 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.576 ' HG3' HD21 ' A' ' 697' ' ' LEU . 5.8 ptm180 -51.91 -48.84 63.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.913 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 9.1 mtt -57.52 -48.52 79.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.935 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -51.22 -44.71 61.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -59.24 -60.53 3.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.931 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.462 ' CE2' HD11 ' A' ' 670' ' ' LEU . 27.9 t80 -47.72 -59.9 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.88 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -46.24 -50.93 15.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.887 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -48.91 -48.14 42.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 3.8 mtm -56.37 -62.37 1.76 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.907 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.462 HD11 ' CE2' ' A' ' 666' ' ' PHE . 49.4 mt -41.23 -38.72 1.18 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 20.8 tp -72.52 -47.33 49.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.921 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . 0.425 ' O ' ' C ' ' A' ' 673' ' ' ARG . 12.3 mm-40 -71.69 -66.02 0.69 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.872 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 672' ' ' GLU . 13.2 mmt-85 -36.26 -39.26 0.17 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.875 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 100.01 29.61 6.75 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.531 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.621 HG12 ' O ' ' A' ' 675' ' ' VAL . 19.4 t -59.57 87.54 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.877 0.37 . . . . 0.0 111.126 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 675' ' ' VAL . 50.8 m -37.15 155.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.861 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -100.11 -4.82 28.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.06 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -117.03 36.3 4.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.889 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.1 m -125.13 -177.02 3.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.841 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 2.8 p -94.14 153.52 18.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.156 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.558 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 29.1 t-105 -63.09 -30.56 71.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.879 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.33 -57.17 13.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 9.2 mttp -56.2 -59.09 5.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.509 ' OE1' ' CZ ' ' A' ' 706' ' ' PHE . 8.1 mt-10 -55.4 -43.75 75.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.918 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.558 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 6.4 tp -47.35 -61.75 1.76 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.57 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.8 p-80 -56.32 -35.36 67.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.859 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.515 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 13.4 mtmt -63.67 -25.47 68.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.867 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 13.7 pt -121.07 11.84 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.143 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.57 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.3 p -80.29 -34.68 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.11 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.448 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 4.8 p90 -67.15 -43.28 82.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.906 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.448 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.5 t70 -46.58 139.72 6.11 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.563 0.696 . . . . 0.0 110.848 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.1 Cg_endo -69.74 -42.0 3.81 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.705 2.27 . . . . 0.0 112.318 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 19.6 mtm-85 -56.71 -23.57 43.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.576 ' CE2' ' HD3' ' A' ' 702' ' ' ARG . 0.8 OUTLIER -65.72 -30.12 70.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.911 -179.859 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.427 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 35.7 mt -78.73 -6.46 55.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.889 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.88 -52.74 10.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.576 HD21 ' HG3' ' A' ' 662' ' ' ARG . 11.7 mt -78.21 156.62 29.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -68.64 164.05 48.92 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.645 0.736 . . . . 0.0 110.857 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -35.41 12.73 Favored 'Trans proline' 0 N--CA 1.465 -0.176 0 C-N-CA 122.717 2.278 . . . . 0.0 112.38 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -72.44 -45.65 58.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.892 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.478 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -60.44 -53.47 57.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.576 ' HD3' ' CE2' ' A' ' 694' ' ' TYR . 68.7 mtt180 -34.49 -46.65 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.899 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 4.4 tmtm? -72.15 -46.23 57.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.841 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -56.26 -55.93 27.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.75 -48.41 81.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.158 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.689 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 19.2 t80 -55.43 -45.48 76.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.906 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -55.66 -47.7 76.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.845 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -64.53 -40.86 96.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.908 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.532 ' CZ ' ' HG3' ' A' ' 713' ' ' ARG . 11.7 t80 -63.95 -46.13 86.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.889 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.689 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 68.9 t -63.71 -48.92 84.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.092 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -51.89 -45.52 64.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -41.07 69.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.147 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.532 ' HG3' ' CZ ' ' A' ' 709' ' ' TYR . 4.7 mmp_? -59.23 -33.32 70.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.908 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.095 179.931 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.53 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.9 Cg_endo . . . . . 0 C--O 1.232 0.202 0 CA-C-O 120.852 0.271 . . . . 0.0 112.335 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 43.0 tp -59.42 -49.43 77.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -52.97 -36.58 60.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.53 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -68.69 -69.49 0.32 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.119 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.711 ' HG3' HD21 ' A' ' 697' ' ' LEU . 4.3 ptm180 -47.72 -53.27 15.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.919 ' HA ' HD11 ' A' ' 697' ' ' LEU . 11.4 mtt -53.24 -44.4 68.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.933 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -31.87 70.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -67.45 -59.32 3.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.83 ' HB2' HD12 ' A' ' 697' ' ' LEU . 26.5 t80 -55.03 -55.82 26.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.889 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . 0.518 ' HA ' HD12 ' A' ' 670' ' ' LEU . 0.2 OUTLIER -54.8 -44.31 73.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.865 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -52.15 -52.75 49.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.859 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.489 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 3.0 ptt? -67.73 -39.09 84.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.908 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 667' ' ' LYS . 24.9 mt -47.52 -46.98 28.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.925 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.7 tp -79.62 -48.2 14.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . 0.433 ' O ' ' N ' ' A' ' 674' ' ' GLY . 27.9 mm-40 -55.6 -66.02 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.897 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 9.1 mmp_? -42.76 -23.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.872 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 87.33 43.99 5.72 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.485 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.458 HG13 ' CG ' ' A' ' 684' ' ' GLU . 87.9 t -71.25 101.42 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.861 0.363 . . . . 0.0 111.18 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 3.2 t -61.35 154.93 22.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.891 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . 0.557 ' HA ' HG13 ' A' ' 710' ' ' VAL . . . -87.3 -47.88 8.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.089 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -58.56 -27.06 64.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 39.2 m -65.96 167.55 9.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 30.3 p -92.29 163.34 13.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.14 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 4.4 t-105 -67.31 -31.5 71.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.923 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -58.83 -56.9 16.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.846 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -56.52 -59.03 5.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.934 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.458 ' CG ' HG13 ' A' ' 675' ' ' VAL . 63.1 mm-40 -53.94 -40.68 67.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 5.7 tp -52.09 -59.12 4.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.932 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.7 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.6 p-80 -56.49 -33.31 65.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.83 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 48.0 mttt -65.56 -31.7 72.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 12.5 pt -112.83 11.07 8.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.11 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.7 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.3 p -76.69 -32.9 21.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.171 179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -74.99 -28.66 60.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.879 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.431 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 11.6 t70 -63.4 139.81 97.63 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.585 0.707 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.2 Cg_endo -69.77 -40.63 5.08 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.703 2.269 . . . . 0.0 112.324 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 36.7 mtm180 -57.99 -22.14 48.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.834 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.637 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 11.6 t80 -67.13 -3.56 7.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.94 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 28.2 mt -111.49 -13.95 13.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.904 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.56 -46.05 90.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.928 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.919 HD11 ' HA ' ' A' ' 663' ' ' MET . 30.1 mt -93.68 140.54 29.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -48.87 162.81 0.36 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.599 0.714 . . . . 0.0 110.924 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . 0.462 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.6 Cg_endo -69.76 -32.18 19.07 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.738 2.292 . . . . 0.0 112.338 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -72.23 -46.92 54.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.861 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.0 -49.84 75.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.879 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.637 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 56.8 mtm180 -42.66 -43.5 3.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.87 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -71.2 -42.86 68.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.903 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -60.4 -57.31 13.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 74.5 t -56.91 -43.69 80.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.118 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.677 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 20.9 t80 -61.74 -43.39 98.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.891 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -55.59 -49.0 73.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -63.47 -38.05 89.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.593 ' C ' ' CD1' ' A' ' 709' ' ' TYR . 0.3 OUTLIER -66.69 -38.15 86.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.927 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.677 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 99.4 t -72.98 -53.7 17.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.137 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -49.42 -51.61 34.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.888 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 10.6 p -66.25 -36.56 83.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.15 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.565 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 9.9 mmm180 -66.02 -34.35 77.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.884 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.082 179.92 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.61 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.1 Cg_endo . . . . . 0 C--O 1.232 0.196 0 CA-C-O 120.802 0.251 . . . . 0.0 112.345 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 21.4 tp -44.25 -36.56 2.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.933 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -71.24 -31.72 67.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.882 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.61 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -66.25 -55.79 14.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.121 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.457 ' HB2' ' CD2' ' A' ' 697' ' ' LEU . 0.0 OUTLIER -60.22 -54.87 40.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.869 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.833 ' HA ' HD11 ' A' ' 697' ' ' LEU . 16.1 mtt -51.05 -47.6 61.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.887 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.54 -45.43 73.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.921 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -59.69 -50.63 73.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.898 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.553 ' CE2' HD11 ' A' ' 670' ' ' LEU . 30.9 t80 -57.74 -58.98 5.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -51.14 -37.69 47.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.891 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -58.24 -52.52 65.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.852 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 693' ' ' ARG . 2.8 ptt? -67.31 -35.82 80.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.909 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' A' ' 666' ' ' PHE . 20.0 mt -52.45 -52.56 53.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.93 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . 0.407 HD13 ' HE ' ' A' ' 713' ' ' ARG . 13.2 tp -78.09 -43.16 29.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -55.31 -65.63 0.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.903 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 10.2 mmp_? -45.86 -26.14 0.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 92.12 38.36 5.72 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.518 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.608 HG13 ' CG ' ' A' ' 684' ' ' GLU . 42.0 t -61.06 112.47 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 111.17 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 16.1 m -70.22 127.51 33.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.878 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -67.97 -53.35 26.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.124 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -51.59 -32.32 28.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.934 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.3 m -62.08 -178.69 0.17 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.804 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 16.9 p -102.5 167.31 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.104 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.464 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 32.6 t-105 -66.9 -24.75 66.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.913 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -64.0 -63.12 1.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.916 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.01 -58.97 4.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.608 ' CG ' HG13 ' A' ' 675' ' ' VAL . 50.0 mm-40 -56.67 -44.63 81.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.866 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.464 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.4 tp -48.22 -50.49 29.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.982 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.764 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.2 p-80 -65.9 -33.87 76.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.577 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 51.7 mttt -65.94 -23.6 66.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.832 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 7.2 pt -117.8 3.17 7.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.182 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.764 HG12 ' O ' ' A' ' 686' ' ' HIS . 7.9 p -68.2 -33.13 58.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.099 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -84.26 5.29 27.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.876 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.488 ' OD1' ' N ' ' A' ' 693' ' ' ARG . 4.7 t70 -92.72 142.63 25.91 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.625 0.726 . . . . 0.0 110.862 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.418 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.9 Cg_endo -69.72 -47.84 0.86 Allowed 'Trans proline' 0 N--CA 1.465 -0.197 0 C-N-CA 122.705 2.27 . . . . 0.0 112.385 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.493 ' HA ' HD12 ' A' ' 696' ' ' LEU . 79.1 mtm180 -53.07 -25.29 12.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.469 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 19.6 t80 -65.66 -5.23 7.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.923 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 30.8 mt -118.05 10.95 13.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.905 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' A' ' 693' ' ' ARG . 94.1 mt -94.12 -31.79 14.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.833 HD11 ' HA ' ' A' ' 663' ' ' MET . 40.1 mt -102.56 141.09 35.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.969 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 -47.5 162.36 0.3 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.667 0.746 . . . . 0.0 110.853 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . 0.42 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.0 Cg_endo -69.72 -34.16 15.27 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.651 2.234 . . . . 0.0 112.374 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -72.27 -44.56 62.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.461 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -62.02 -49.64 75.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.432 ' NH1' ' O ' ' A' ' 694' ' ' TYR . 43.3 mtm180 -42.7 -44.69 4.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.903 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 7.7 tppt? -69.3 -46.33 67.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -57.03 -55.07 39.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.881 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.6 t -58.68 -37.47 65.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.105 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.567 ' O ' HG23 ' A' ' 710' ' ' VAL . 75.0 t80 -67.27 -34.6 77.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -64.7 -54.22 34.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.883 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . 0.461 ' CG ' ' N ' ' A' ' 709' ' ' TYR . 7.6 pt20 -57.84 -45.38 86.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.941 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.693 ' CD2' ' CZ ' ' A' ' 713' ' ' ARG . 2.7 t80 -56.99 -52.71 64.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.922 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 706' ' ' PHE . 92.3 t -59.66 -39.23 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.168 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -53.54 -51.25 63.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.967 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . 0.436 ' O ' ' N ' ' A' ' 714' ' ' ALA . 20.3 p -70.03 -67.12 0.51 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.156 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.693 ' CZ ' ' CD2' ' A' ' 709' ' ' TYR . 10.4 mpt_? -42.34 -23.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.869 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 712' ' ' THR . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.1 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.5 Cg_endo . . . . . 0 C--O 1.231 0.167 0 CA-C-O 120.879 0.283 . . . . 0.0 112.3 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 25.6 tp -56.07 -47.29 78.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 661' ' ' ALA . 8.1 pt-20 -56.35 -36.0 68.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . 0.536 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -68.39 -71.04 0.23 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.105 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -46.92 -48.96 21.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.839 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.436 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.4 mtt -55.25 -49.09 72.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.859 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.71 -48.23 50.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.939 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' A' ' 669' ' ' MET . 72.5 mt-30 -56.7 -61.21 2.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.901 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.557 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 21.2 t80 -43.53 -60.62 1.67 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -51.04 -47.71 61.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.902 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -50.18 -41.15 48.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.915 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.403 ' HG3' ' O ' ' A' ' 665' ' ' GLN . 4.4 mtm -65.4 -63.42 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.864 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 57.3 mt -39.38 -40.11 0.76 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.919 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 19.8 tp -76.64 -45.9 28.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.928 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -65.22 -62.77 1.34 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -46.23 -21.81 0.19 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.898 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 84.29 42.68 7.36 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.506 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.66 HG13 ' CG ' ' A' ' 684' ' ' GLU . 37.3 t -70.01 100.61 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.837 0.351 . . . . 0.0 111.115 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 20.3 m -56.2 141.22 41.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.843 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -77.85 -37.87 47.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.07 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -81.47 44.92 0.83 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.902 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.7 m -133.67 -177.2 4.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.896 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . 0.626 HG23 ' H ' ' A' ' 683' ' ' LYS . 5.2 t -99.1 154.14 18.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.154 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.558 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 3.3 t-105 -65.47 -32.63 74.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -57.97 -48.89 78.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.918 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.626 ' H ' HG23 ' A' ' 680' ' ' THR . 32.4 mttm -62.85 -59.02 5.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.909 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.66 ' CG ' HG13 ' A' ' 675' ' ' VAL . 56.0 mm-40 -55.76 -37.3 68.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.558 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 8.0 tp -56.58 -62.94 1.38 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.919 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.756 ' O ' HG12 ' A' ' 689' ' ' VAL . 2.1 p-80 -51.72 -36.01 45.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.582 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 37.5 mttm -64.26 -33.47 75.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.918 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 23.9 pt -108.09 10.06 9.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.092 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.756 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.3 p -78.17 -11.71 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.115 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.424 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 11.4 p90 -90.49 -41.61 11.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.879 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.424 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 10.6 t70 -53.59 139.8 48.77 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.595 0.712 . . . . 0.0 110.875 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.8 Cg_endo -69.76 -42.49 3.35 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.659 2.239 . . . . 0.0 112.372 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.459 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 22.4 mtm-85 -53.41 -20.66 4.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.897 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.576 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 40.3 t80 -63.3 -25.56 68.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.884 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 28.6 mt -85.73 -20.26 29.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.944 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.459 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 78.8 mt -59.27 -47.65 84.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.967 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 663' ' ' MET . 10.8 mt -85.18 145.1 27.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.884 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -60.55 164.16 7.65 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.646 0.736 . . . . 0.0 110.861 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . 0.415 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.2 Cg_endo -69.67 -34.05 15.66 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.642 2.228 . . . . 0.0 112.394 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -72.38 -47.03 52.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.414 ' O ' ' C ' ' A' ' 702' ' ' ARG . 6.0 mm-40 -61.46 -54.17 46.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.821 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.576 ' NH1' ' CE2' ' A' ' 694' ' ' TYR . 30.6 mtm180 -37.1 -45.04 0.58 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.924 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 3.2 tppt? -70.27 -45.8 65.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.924 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -60.84 -58.98 6.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.887 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 44.1 t -50.68 -52.54 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.146 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.412 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 20.2 t80 -51.1 -55.14 19.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.858 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -45.49 -51.18 12.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -60.63 -44.42 96.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.939 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.467 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 1.5 t80 -56.97 -42.63 80.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.951 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.412 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 85.0 t -66.3 -39.3 83.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.137 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 46.9 tttt -58.82 -41.34 86.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.87 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.8 p -73.74 -41.68 62.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.477 ' HA ' ' CZ ' ' A' ' 713' ' ' ARG . 0.1 OUTLIER -66.3 -27.0 67.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.861 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.102 179.949 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--O 1.232 0.204 0 CA-C-O 120.796 0.248 . . . . 0.0 112.33 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 36.2 tp -53.48 -47.35 69.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.912 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 660' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 1.5 mp0 -56.53 -34.2 66.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.874 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.97 -67.93 0.43 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.046 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 662' ' ' ARG . . . . . 0.471 ' HE ' HD23 ' A' ' 697' ' ' LEU . 6.4 ptm180 -48.62 -55.69 10.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.921 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.9 mtt -54.15 -47.18 72.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.867 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 664' ' ' LYS . . . . . 0.439 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 11.7 mmmt -51.18 -48.88 61.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.869 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -56.44 -60.72 3.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.933 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 666' ' ' PHE . . . . . 0.477 ' CE2' HD11 ' A' ' 670' ' ' LEU . 19.3 t80 -46.41 -62.01 1.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 57.5 tttt -47.55 -49.18 27.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.914 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -47.62 -49.63 26.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.867 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 669' ' ' MET . . . . . 0.454 ' O ' ' N ' ' A' ' 672' ' ' GLU . 4.6 mtm -59.07 -64.51 0.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.849 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 670' ' ' LEU . . . . . 0.477 HD11 ' CE2' ' A' ' 666' ' ' PHE . 50.4 mt -37.54 -41.7 0.48 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.916 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 23.4 tp -76.8 -38.76 53.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.909 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 672' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' A' ' 669' ' ' MET . 5.7 mm-40 -73.29 -65.98 0.74 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.888 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 673' ' ' ARG . . . . . 0.434 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 5.4 mmp_? -39.63 -33.91 0.21 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.837 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 97.89 25.09 10.87 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.48 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 675' ' ' VAL . . . . . 0.624 HG13 ' CD ' ' A' ' 684' ' ' GLU . 39.8 t -51.82 97.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.84 0.353 . . . . 0.0 111.103 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 43.4 m -54.75 132.14 45.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -64.95 -47.55 77.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.098 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -76.85 48.02 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.867 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.3 t -130.84 176.61 8.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.901 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 61.1 p -94.51 142.1 27.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.107 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 681' ' ' TRP . . . . . 0.521 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 34.9 t-105 -57.12 -31.65 65.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.964 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -60.32 -56.01 26.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.881 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 683' ' ' LYS . . . . . 0.552 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 44.6 mttt -57.99 -59.01 5.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.908 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 684' ' ' GLU . . . . . 0.624 ' CD ' HG13 ' A' ' 675' ' ' VAL . 21.6 mm-40 -56.04 -41.04 74.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.898 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 685' ' ' LEU . . . . . 0.521 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 9.4 tp -50.63 -58.88 4.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.935 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 686' ' ' HIS . . . . . 0.588 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.8 p-80 -60.62 -29.96 69.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.86 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 687' ' ' LYS . . . . . 0.418 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 66.4 mttt -67.03 -27.59 67.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.943 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 13.1 pt -117.97 8.3 6.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.104 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.588 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.0 p -74.84 -28.36 21.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.157 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 690' ' ' PHE . . . . . 0.465 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 13.6 p90 -73.49 -44.53 57.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.845 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 691' ' ' ASP . . . . . 0.465 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.8 t70 -40.82 139.77 1.14 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.627 0.727 . . . . 0.0 110.861 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.77 -39.17 6.8 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.679 2.253 . . . . 0.0 112.339 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 693' ' ' ARG . . . . . 0.477 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 79.4 mtm180 -61.36 -27.19 68.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.809 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 694' ' ' TYR . . . . . 0.519 ' CD1' ' C ' ' A' ' 694' ' ' TYR . 1.4 t80 -62.7 -23.62 67.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.923 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.418 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 20.2 mt -91.17 9.26 31.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.953 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 696' ' ' LEU . . . . . 0.477 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 89.6 mt -89.77 -40.84 12.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 697' ' ' LEU . . . . . 0.471 HD23 ' HE ' ' A' ' 662' ' ' ARG . 60.7 mt -91.97 166.0 12.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.894 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 698' ' ' ASN . . . . . 0.503 ' ND2' ' OE2' ' A' ' 701' ' ' GLU . 0.2 OUTLIER -78.58 165.39 50.1 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.623 0.725 . . . . 0.0 110.89 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 699' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 698' ' ' ASN . 53.7 Cg_endo -69.77 -26.11 27.88 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.725 2.283 . . . . 0.0 112.353 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -72.47 -47.8 45.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.915 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 701' ' ' GLU . . . . . 0.503 ' OE2' ' ND2' ' A' ' 698' ' ' ASN . 0.0 OUTLIER -66.17 -52.75 45.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.887 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 702' ' ' ARG . . . . . 0.449 ' NH2' ' O ' ' A' ' 697' ' ' LEU . 79.8 mtt180 -35.13 -44.66 0.26 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.874 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 19.3 tptp -74.48 -48.76 25.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -55.81 -57.73 10.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.94 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 89.9 t -56.71 -49.86 76.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.112 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 706' ' ' PHE . . . . . 0.512 ' CD2' ' CE3' ' A' ' 681' ' ' TRP . 20.1 t80 -53.22 -41.15 65.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.85 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.37 -46.19 91.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.866 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -61.03 -39.86 91.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.916 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 709' ' ' TYR . . . . . 0.461 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 22.7 t80 -63.06 -43.25 99.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.917 -179.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 710' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 706' ' ' PHE . 86.8 t -63.49 -48.93 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.087 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 35.9 tttt -54.11 -48.54 70.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 2.3 p -66.58 -37.25 84.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.159 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 713' ' ' ARG . . . . . 0.461 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.2 mmm180 -66.54 -28.24 68.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.156 179.892 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 N-CA-C 112.454 -0.259 . . . . 0.0 112.454 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 2.0 m 44.87 42.27 5.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.881 0.372 . . . . 0.0 110.845 -179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 35.5 t -89.72 136.93 32.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.881 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 77.0 101.6 0.16 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.47 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 60.3 p -45.09 119.98 2.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.882 0.373 . . . . 0.0 110.891 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 38.3 m -46.7 -50.73 17.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.864 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . 0.413 ' O ' ' C ' ' A' ' 651' ' ' ALA . . . 158.2 46.51 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.442 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . 0.413 ' C ' ' O ' ' A' ' 650' ' ' GLY . . . -36.91 112.79 0.21 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.77 0.319 . . . . 0.0 111.122 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -56.92 -32.58 66.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -104.02 176.95 4.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.911 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 14.6 ttp180 -80.91 -64.01 1.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.915 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -122.0 25.24 9.21 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.108 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 94.6 mt -121.67 112.7 36.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.13 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 6.2 m -52.46 144.16 24.69 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.617 0.722 . . . . 0.0 111.141 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.514 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo -69.73 163.08 39.57 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.686 2.257 . . . . 0.0 112.347 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 14.8 tp -56.02 -47.3 78.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.888 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -58.01 -33.69 69.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.867 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.514 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -67.45 -67.17 0.48 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.104 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.806 ' HG3' HD21 ' A' ' 697' ' ' LEU . 14.9 ptt180 -53.82 -47.22 71.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.849 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.436 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.3 mtt -54.99 -41.35 71.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.886 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -61.58 -43.48 98.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.912 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -57.47 -57.89 10.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.951 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.635 ' CD1' ' HE2' ' A' ' 669' ' ' MET . 25.1 t80 -51.99 -52.49 50.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.898 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.406 ' HA ' HD12 ' A' ' 670' ' ' LEU . 12.4 ttmt -55.89 -37.21 68.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.905 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.86 -52.16 66.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.838 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.635 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 2.8 ptt? -66.92 -37.46 84.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.884 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.454 HD11 ' CE2' ' A' ' 666' ' ' PHE . 29.6 mt -52.25 -48.86 64.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.938 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.8 tp -77.5 -45.75 24.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.928 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -57.1 -66.04 0.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.891 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 10.4 mmp_? -43.76 -25.68 0.2 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.872 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 89.2 43.84 5.19 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.515 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.452 HG13 ' CG ' ' A' ' 684' ' ' GLU . 40.4 t -68.06 97.87 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.853 0.359 . . . . 0.0 111.128 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 8.7 t -51.42 143.92 10.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.815 -179.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -80.89 -42.08 22.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.133 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 -82.94 47.67 1.25 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.885 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.8 m -131.9 -178.62 4.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.856 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . 0.482 HG23 ' H ' ' A' ' 683' ' ' LYS . 1.7 t -101.7 151.45 22.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.125 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.411 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 26.1 t-105 -59.43 -25.59 64.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.957 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.58 -56.64 14.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.904 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.482 ' H ' HG23 ' A' ' 680' ' ' THR . 38.4 mttp -56.13 -59.04 5.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.882 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.452 ' CG ' HG13 ' A' ' 675' ' ' VAL . 37.7 mm-40 -54.92 -40.6 70.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.908 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.411 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 11.7 tp -51.77 -59.41 4.33 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.883 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.594 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.1 p-80 -59.2 -29.81 67.76 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.908 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.475 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 45.9 mttm -68.03 -28.12 67.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.849 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 25.3 pt -117.88 10.45 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.113 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.594 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.7 p -74.4 -37.6 45.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.091 179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.475 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 7.2 p90 -80.5 9.41 6.03 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.868 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.423 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 10.0 t70 -93.68 139.81 22.88 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.595 0.712 . . . . 0.0 110.858 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.9 Cg_endo -69.8 -43.06 2.85 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.671 2.247 . . . . 0.0 112.358 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.479 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 70.9 mtm180 -58.47 -21.66 52.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.846 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.644 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 1.8 t80 -67.04 -18.69 65.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.937 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 12.2 mt -97.29 7.26 46.92 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.479 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 83.4 mt -91.13 -31.2 16.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.806 HD21 ' HG3' ' A' ' 662' ' ' ARG . 27.2 mt -104.12 152.39 22.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.894 179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -57.31 161.86 4.99 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.693 0.758 . . . . 0.0 110.887 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 -37.23 9.52 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.696 2.264 . . . . 0.0 112.362 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -72.1 -45.52 60.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.415 ' O ' ' C ' ' A' ' 702' ' ' ARG . 36.9 mt-10 -56.95 -53.15 61.24 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.899 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.644 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 47.5 mtt180 -36.28 -52.24 0.8 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.837 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 15.6 tptp -65.38 -45.07 85.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -56.35 -57.89 10.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.866 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 71.4 t -59.04 -29.98 42.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.109 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.411 ' O ' HG23 ' A' ' 710' ' ' VAL . 43.1 t80 -71.08 -47.95 55.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.904 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -55.89 -52.64 63.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.881 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -60.33 -41.8 94.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.893 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -58.99 -41.22 87.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.858 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 706' ' ' PHE . 78.2 t -68.95 -43.04 82.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.067 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 20.4 ttpt -53.23 -51.25 62.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.894 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 47.3 p -66.74 -35.73 80.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.149 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.409 ' HA ' ' NE ' ' A' ' 713' ' ' ARG . 5.0 mmp_? -66.45 -29.47 69.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -83.2 -46.45 12.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.14 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . 0.408 ' O ' ' N ' ' A' ' 717' ' ' GLU . 4.5 pt-20 -57.72 -41.98 82.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.871 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -41.1 -27.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.886 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . 0.454 ' O ' ' C ' ' A' ' 718' ' ' ARG . 8.9 tt0 -57.99 -51.39 69.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.842 -179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . 0.454 ' C ' ' O ' ' A' ' 717' ' ' GLU . 5.4 ttt180 -34.28 -41.52 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.859 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -67.15 145.14 55.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.919 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 79.3 p -40.06 -49.56 2.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.885 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 149.25 174.86 21.12 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.502 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -4.79 14.74 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.704 2.269 . . . . 0.0 112.36 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 41.3 p -52.82 137.8 31.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 4.6 p -137.35 129.52 29.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.906 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.263 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.459 -179.942 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 112.536 -0.226 . . . . 0.0 112.536 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 70.4 m -156.83 148.82 22.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.859 0.362 . . . . 0.0 110.832 -179.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 53.8 p -139.82 173.11 11.85 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.822 -179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 161.44 111.57 0.27 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.509 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 3.1 t -158.12 116.14 3.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.893 0.378 . . . . 0.0 110.879 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 66.5 m -78.48 137.05 37.75 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.88 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -171.53 53.65 0.18 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.487 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -138.07 122.97 18.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.788 0.328 . . . . 0.0 111.086 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 6.2 tpt180 -58.82 -47.68 83.97 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.852 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 34.8 tp10 -69.25 85.2 0.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.922 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . 0.455 ' HB2' ' CZ ' ' A' ' 654' ' ' ARG . 3.4 ptm85 -58.73 147.37 33.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.867 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -88.57 151.99 22.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 36.7 mm -120.16 106.16 18.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.154 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . 0.521 ' HB ' ' HB3' ' A' ' 661' ' ' ALA . 3.2 m -63.77 153.94 82.3 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.653 0.74 . . . . 0.0 111.105 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.401 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.1 Cg_endo -69.78 155.33 66.14 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.637 2.225 . . . . 0.0 112.335 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 26.4 tp -46.22 -47.58 17.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.933 179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -57.65 -35.68 70.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.909 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.521 ' HB3' ' HB ' ' A' ' 657' ' ' VAL . . . -67.68 -70.46 0.26 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.104 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.635 ' HG3' HD21 ' A' ' 697' ' ' LEU . 5.2 ptm180 -46.8 -51.63 16.02 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.885 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.693 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.1 mtt -56.97 -50.1 73.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.87 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -51.25 -41.83 60.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.899 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 53.6 mt-30 -61.49 -65.45 0.69 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.912 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.751 ' HB2' HD12 ' A' ' 697' ' ' LEU . 21.6 t80 -44.81 -49.12 10.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.864 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 43.7 tttt -63.22 -42.26 99.24 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.922 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -52.83 -36.39 58.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.41 ' HG2' ' NH1' ' A' ' 693' ' ' ARG . 6.3 mtm -73.81 -60.54 2.21 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 54.3 mt -39.23 -42.32 0.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.948 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 17.2 tp -78.46 -50.45 11.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.918 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -59.73 -65.91 0.6 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.858 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 -41.83 -32.84 0.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.896 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 96.24 31.4 7.24 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.489 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.79 HG13 ' HG2' ' A' ' 684' ' ' GLU . 69.6 t -55.11 103.44 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.874 0.368 . . . . 0.0 111.116 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 59.3 m -59.3 137.51 57.96 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.839 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -72.96 1.6 8.51 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.092 179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -121.86 24.02 9.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.88 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.6 t -105.72 161.95 13.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.839 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 11.5 p -88.66 147.8 24.34 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.172 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.492 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 56.1 t-105 -50.98 -28.07 9.09 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -62.9 -61.74 2.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.896 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.569 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 0.6 OUTLIER -54.54 -59.06 5.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.924 179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.79 ' HG2' HG13 ' A' ' 675' ' ' VAL . 9.0 mt-10 -54.8 -41.05 70.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.916 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.492 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 8.1 tp -52.43 -68.59 0.16 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.931 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.569 ' CE1' ' HA ' ' A' ' 683' ' ' LYS . 4.4 p-80 -50.18 -31.64 14.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.861 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.401 ' HG3' ' NE2' ' A' ' 686' ' ' HIS . 45.6 mttt -68.35 -28.29 67.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.892 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 24.3 pt -119.15 15.48 6.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.14 179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.498 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -83.85 -39.36 14.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.141 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.409 ' N ' ' CG1' ' A' ' 689' ' ' VAL . 15.4 p90 -68.24 -20.93 64.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.868 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.42 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.6 t70 -72.11 139.75 82.47 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.619 0.723 . . . . 0.0 110.873 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.77 -38.74 7.36 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.681 2.254 . . . . 0.0 112.367 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.551 ' HA ' HD12 ' A' ' 696' ' ' LEU . 59.4 mtm180 -53.84 -27.49 30.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.868 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.644 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 15.7 t80 -63.0 -23.41 67.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.93 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 17.4 mt -100.75 18.03 20.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.95 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 693' ' ' ARG . 74.2 mt -99.93 -41.53 7.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.909 179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.751 HD12 ' HB2' ' A' ' 666' ' ' PHE . 29.2 mt -89.67 146.51 24.47 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.904 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 9.6 m-20 -47.09 161.47 0.3 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.627 0.727 . . . . 0.0 110.895 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -37.04 9.83 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.698 2.265 . . . . 0.0 112.34 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.02 -37.69 69.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.948 179.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.437 ' O ' ' C ' ' A' ' 702' ' ' ARG . 8.3 mt-10 -62.53 -55.3 28.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.879 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.644 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 50.1 mtm180 -34.5 -47.43 0.31 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.862 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 9.4 tppt? -71.2 -46.95 60.17 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.885 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -57.88 -59.98 4.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.901 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 96.1 t -52.62 -50.72 39.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.13 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.413 ' CZ ' ' OE1' ' A' ' 684' ' ' GLU . 20.9 t80 -49.11 -46.06 44.28 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.898 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -57.8 -54.78 43.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.881 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -52.84 -47.3 67.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.895 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.531 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 12.3 t80 -52.53 -51.03 61.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.951 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . . . . . . . . . 41.1 t -58.02 -50.7 77.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.115 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -44.69 -56.42 4.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.908 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 39.7 p -60.35 -47.33 86.5 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.116 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.531 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.1 mmm180 -54.72 -21.73 11.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.869 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -85.59 -54.36 4.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.054 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -52.28 -36.12 52.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.908 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -84.63 22.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.916 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -64.48 104.0 0.73 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.923 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 17.0 mmt180 -67.9 156.56 36.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.906 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -86.8 -58.35 2.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.843 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 37.8 t -100.92 41.73 1.16 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.842 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -99.81 177.94 29.46 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.494 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 93.23 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.682 2.255 . . . . 0.0 112.334 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 63.8 m -147.73 152.91 38.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.87 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 89.6 p -64.57 111.17 2.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.832 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.5 -179.999 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.308 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 81.3 p -81.87 112.06 18.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.909 0.385 . . . . 0.0 110.873 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 31.0 t -57.44 -48.71 78.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.812 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 109.03 -72.03 0.2 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.481 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 84.8 p -114.77 109.53 18.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.858 0.361 . . . . 0.0 110.863 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 35.2 t -124.24 107.56 11.32 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.79 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -149.41 101.3 0.22 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.486 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -104.73 79.67 1.56 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.805 0.336 . . . . 0.0 111.118 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -109.44 174.28 5.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.897 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -85.76 -59.09 2.41 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.925 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -127.94 121.73 30.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -134.03 118.03 17.34 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.065 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 73.6 mt -79.93 96.42 2.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.138 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . 0.507 HG23 ' HD2' ' A' ' 658' ' ' PRO . 5.4 p -47.96 134.68 11.51 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.605 0.717 . . . . 0.0 111.138 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.551 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.5 Cg_endo -69.8 156.69 62.61 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.67 2.247 . . . . 0.0 112.329 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 17.7 tp -58.78 -50.72 72.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . 0.47 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 6.0 tp10 -51.26 -34.43 32.69 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.91 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.551 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -70.62 -71.07 0.26 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.085 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -48.01 -49.79 29.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.864 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.682 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.9 mtt -55.91 -45.7 78.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.878 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . 0.47 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 8.5 mmmt -55.83 -42.26 75.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -59.4 -56.52 21.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.904 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.589 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 25.8 t80 -50.15 -49.71 51.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.893 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 33.8 tttt -62.16 -36.71 82.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.871 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -59.46 -45.21 92.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.866 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.459 ' CG ' ' O ' ' A' ' 666' ' ' PHE . 3.0 ptt? -72.26 -38.67 68.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.9 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 25.3 mt -52.17 -47.49 65.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.954 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 22.0 tp -77.02 -50.36 13.29 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.94 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -53.19 -66.05 0.45 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.885 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -43.95 -31.36 0.87 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.874 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 96.25 45.9 2.7 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.502 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.408 HG13 ' CG ' ' A' ' 684' ' ' GLU . 74.7 t -72.4 89.57 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.857 0.36 . . . . 0.0 111.12 -179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 41.9 m -56.83 123.84 16.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.871 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . 0.86 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -56.62 -31.8 64.67 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.072 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -70.0 -22.88 63.09 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.871 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 24.5 t -67.1 173.62 3.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.845 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 25.2 p -104.42 158.21 16.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.165 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.461 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 44.9 t-105 -59.87 -33.19 71.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -60.97 -58.6 7.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.92 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.489 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 63.6 mttt -57.15 -59.06 5.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.843 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.408 ' CG ' HG13 ' A' ' 675' ' ' VAL . 13.2 mt-10 -55.5 -38.28 68.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.853 -179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.461 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 5.1 tp -53.5 -52.95 57.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.933 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.796 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.0 p-80 -65.52 -29.12 69.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.863 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 61.7 mttt -68.72 -33.28 73.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.949 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . 0.417 ' O ' ' CB ' ' A' ' 694' ' ' TYR . 7.5 pt -111.04 6.91 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.137 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.796 HG12 ' O ' ' A' ' 686' ' ' HIS . 8.0 p -66.03 -25.07 35.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.14 179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.514 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 9.1 p90 -85.52 -47.15 10.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.877 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.514 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.4 t70 -34.28 142.05 0.23 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.626 0.727 . . . . 0.0 110.829 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.414 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.76 -39.32 6.66 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.715 2.276 . . . . 0.0 112.358 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.505 ' HA ' HD12 ' A' ' 696' ' ' LEU . 11.9 mtm-85 -67.19 -21.58 65.78 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.859 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.417 ' CB ' ' O ' ' A' ' 688' ' ' ILE . 18.8 t80 -63.96 -18.77 64.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 18.9 mt -109.9 23.53 14.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.948 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 693' ' ' ARG . 81.3 mt -105.12 -25.6 12.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.907 179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.682 HD11 ' HA ' ' A' ' 663' ' ' MET . 27.9 mt -110.5 144.56 39.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.895 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -50.75 163.12 0.5 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.584 0.707 . . . . 0.0 110.893 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -31.7 20.02 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.706 2.271 . . . . 0.0 112.299 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -45.04 61.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.902 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 5.5 mm-40 -59.07 -54.53 46.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.907 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.589 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 38.1 mtp180 -34.28 -50.43 0.41 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.864 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.0 tptp -68.0 -45.67 73.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.895 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . 0.409 ' N ' ' O ' ' A' ' 701' ' ' GLU . 10.9 mm-40 -58.23 -60.32 3.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.913 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.4 t -54.71 -46.63 73.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.167 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.674 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 25.2 t80 -60.76 -41.4 95.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.907 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -54.92 -53.03 60.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.833 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -61.64 -39.04 89.91 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.929 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -63.99 -39.07 93.3 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.937 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.86 HG13 ' HB1' ' A' ' 677' ' ' ALA . 86.6 t -69.6 -53.92 22.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.114 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 12.8 mtpp -48.14 -48.47 34.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 45.3 p -66.85 -38.95 87.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.146 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 12.6 mmt-85 -62.19 -47.16 85.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -74.29 -54.56 7.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.104 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 1.8 pp20? -51.1 -28.25 10.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.905 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -96.46 27.76 3.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.921 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.16 119.79 4.34 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.894 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . 0.479 ' HB2' ' CZ ' ' A' ' 718' ' ' ARG . 12.1 mtm105 -111.53 96.19 5.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . 0.439 ' NE ' ' HA ' ' A' ' 719' ' ' ARG . 11.3 mmp_? -70.31 172.95 7.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.845 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 11.1 p -90.12 148.46 22.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.829 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -124.19 -94.92 1.1 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.476 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 -7.31 20.74 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.679 2.253 . . . . 0.0 112.299 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 27.1 m -99.11 142.38 30.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.886 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 3.5 m -156.09 159.67 39.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.857 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.505 -179.974 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 49.4 m -130.89 82.11 2.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.853 0.359 . . . . 0.0 110.908 -179.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 2.5 t -38.34 104.97 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.865 -179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 128.73 127.38 2.96 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.508 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 23.3 m -144.31 171.23 14.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.899 0.38 . . . . 0.0 110.85 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 23.2 t 52.2 43.69 30.39 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.851 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -149.32 151.79 23.87 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.46 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -43.0 101.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.764 0.316 . . . . 0.0 111.086 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 60.4 mtt-85 -89.65 154.18 20.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.863 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.3 131.43 42.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.889 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 13.3 mtp85 -129.87 -53.23 1.14 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.907 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -118.06 50.78 1.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.087 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . 0.403 ' O ' ' HD3' ' A' ' 658' ' ' PRO . 8.0 mm -132.98 95.43 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.133 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . 0.68 ' O ' HG13 ' A' ' 657' ' ' VAL . 12.2 p -101.28 98.35 8.86 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.664 0.745 . . . . 0.0 111.12 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.488 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo -69.8 156.44 63.24 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.684 2.256 . . . . 0.0 112.323 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 21.9 tp -59.99 -48.82 80.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.908 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -51.95 -32.76 34.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.855 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.488 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -74.0 -68.83 0.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.087 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.564 ' HG3' HD21 ' A' ' 697' ' ' LEU . 6.5 ptm180 -48.7 -48.36 40.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.891 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.766 ' HA ' HD11 ' A' ' 697' ' ' LEU . 9.2 mtt -59.05 -51.26 70.83 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.883 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 10.7 mmmt -50.39 -39.37 46.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.886 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -63.24 -58.16 8.08 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.862 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.723 ' HB2' HD12 ' A' ' 697' ' ' LEU . 23.2 t80 -51.9 -43.95 63.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.897 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 34.0 tttp -69.7 -39.25 77.01 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.859 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -57.67 -43.32 84.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.871 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -71.99 -37.95 69.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.892 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.49 HD23 HG21 ' A' ' 675' ' ' VAL . 27.1 mt -53.86 -46.54 71.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 42.9 tp -75.46 -51.28 13.4 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.953 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -54.85 -63.62 1.09 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.928 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 12.7 mmp_? -45.78 -24.29 0.36 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.881 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 86.44 44.42 5.87 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.527 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.61 HG13 ' CD ' ' A' ' 684' ' ' GLU . 54.9 t -70.11 107.81 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.812 0.339 . . . . 0.0 111.162 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 39.1 m -63.36 149.87 44.79 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . 0.604 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -81.4 -52.94 6.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.131 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -57.79 -13.55 4.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.892 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -75.03 172.37 12.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.862 -179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 2.4 t -105.25 165.14 11.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.186 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.49 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 40.6 t-105 -62.73 -26.52 68.72 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.903 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -61.47 -62.11 2.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.902 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.405 ' O ' ' ND1' ' A' ' 686' ' ' HIS . 39.8 mttp -53.52 -58.94 5.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.914 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.61 ' CD ' HG13 ' A' ' 675' ' ' VAL . 46.7 mm-40 -55.48 -45.79 76.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.903 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.49 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.7 tp -45.59 -55.11 6.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.906 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.707 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.7 p-80 -64.13 -31.63 72.89 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.856 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.552 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 56.9 mttm -68.97 -22.84 64.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 8.7 pt -118.48 5.0 6.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.119 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.707 HG12 ' O ' ' A' ' 686' ' ' HIS . 7.9 p -69.9 -27.95 34.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.141 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.552 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 6.7 p90 -86.1 3.66 41.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.446 ' OD1' ' NH2' ' A' ' 693' ' ' ARG . 9.4 t70 -94.96 139.8 22.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.605 0.717 . . . . 0.0 110.864 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.8 -34.02 15.3 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.675 2.25 . . . . 0.0 112.323 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.624 ' HA ' HD12 ' A' ' 696' ' ' LEU . 16.8 mtm-85 -67.49 -20.03 65.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.881 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -65.8 -16.96 64.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.969 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.1 mt -113.27 16.84 18.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.921 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.624 HD12 ' HA ' ' A' ' 693' ' ' ARG . 54.8 mt -96.03 -19.68 19.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.846 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.766 HD11 ' HA ' ' A' ' 663' ' ' MET . 30.8 mt -114.83 148.19 38.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.884 179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 26.4 m-20 -50.1 161.91 0.54 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.6 0.715 . . . . 0.0 110.93 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.79 -33.71 15.93 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.652 2.235 . . . . 0.0 112.288 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -72.01 -45.31 61.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.892 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 71.6 mm-40 -57.47 -53.47 57.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.876 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.585 ' HG2' ' CE2' ' A' ' 666' ' ' PHE . 10.7 mtp180 -34.42 -47.95 0.33 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.869 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 11.4 tmtt? -71.45 -45.35 62.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.892 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . 0.41 ' N ' ' O ' ' A' ' 701' ' ' GLU . 46.0 mm-40 -57.88 -59.26 5.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.906 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 91.6 t -55.62 -48.37 77.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.126 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.436 ' O ' HG23 ' A' ' 710' ' ' VAL . 26.4 t80 -56.34 -43.8 79.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.917 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -55.32 -53.24 58.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.863 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -58.08 -38.83 77.1 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.887 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -62.8 -42.78 99.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.917 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.604 HG13 ' HB1' ' A' ' 677' ' ' ALA . 89.2 t -67.36 -41.61 86.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.163 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -59.14 -39.06 81.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.864 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . 0.413 ' HA ' ' CG ' ' A' ' 715' ' ' GLU . 21.2 p -74.09 -40.38 62.77 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.123 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -66.17 -26.37 67.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.868 -179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -91.79 -49.19 6.39 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.094 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . 0.413 ' CG ' ' HA ' ' A' ' 712' ' ' THR . 2.2 pp20? -54.27 -34.72 61.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.891 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . 0.453 ' CD ' ' O ' ' A' ' 716' ' ' GLU . 0.1 OUTLIER -52.13 -17.96 1.28 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.91 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . 0.435 ' O ' ' C ' ' A' ' 718' ' ' ARG . 8.4 tt0 -110.54 150.29 29.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.88 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 717' ' ' GLU . 9.5 mmp_? -34.5 -51.89 0.48 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.817 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 30.6 mtt180 -49.82 99.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.897 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 59.7 p -174.62 119.81 0.23 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.886 -179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -106.13 159.28 15.19 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.522 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.78 118.15 5.51 Favored 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.674 2.25 . . . . 0.0 112.38 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . 0.418 ' O ' ' C ' ' A' ' 724' ' ' SER . 65.7 p -83.08 83.3 7.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.9 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . 0.418 ' C ' ' O ' ' A' ' 723' ' ' SER . 6.8 t 37.04 42.86 0.27 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.827 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.523 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.45 -0.26 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 4.2 m 62.14 51.16 3.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.881 0.372 . . . . 0.0 110.859 -179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 66.8 m -84.75 140.99 30.85 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.882 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 171.14 109.6 0.23 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.466 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 50.0 m -113.88 -46.38 3.03 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.899 0.381 . . . . 0.0 110.865 -179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 51.4 p -169.21 176.5 5.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.834 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -167.27 125.99 1.38 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.455 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -39.11 130.12 1.59 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.761 0.315 . . . . 0.0 111.126 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 23.6 ptt180 -129.34 151.15 50.29 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.861 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 64.9 mt-10 -112.4 -59.62 1.98 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.873 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 1.6 mpt_? -108.18 158.31 17.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.854 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -83.43 80.1 9.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.094 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . 0.631 HG22 ' HD3' ' A' ' 658' ' ' PRO . 73.9 mt -120.18 109.5 26.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.14 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 85.0 t -110.33 82.06 2.55 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.559 0.695 . . . . 0.0 111.107 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.631 ' HD3' HG22 ' A' ' 656' ' ' ILE . 53.9 Cg_endo -69.82 167.52 24.28 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.684 2.256 . . . . 0.0 112.36 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.5 HD12 ' HE ' ' A' ' 662' ' ' ARG . 14.5 tp -51.91 -54.84 24.76 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.899 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -53.71 -35.86 61.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.899 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.402 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -64.0 -70.94 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.125 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.5 ' HE ' HD12 ' A' ' 659' ' ' LEU . 14.7 ptt180 -50.8 -48.14 59.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.831 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.652 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.5 mtt -54.05 -42.73 69.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.873 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -58.85 -47.4 84.99 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.902 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -55.42 -52.12 64.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.89 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.747 ' HB2' HD12 ' A' ' 697' ' ' LEU . 25.1 t80 -54.46 -57.44 11.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.849 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.568 ' HA ' HD12 ' A' ' 670' ' ' LEU . 16.9 ttmt -54.63 -35.98 64.01 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.968 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -60.1 -52.85 63.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.888 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.531 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 2.7 ptt? -65.14 -36.58 84.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.901 179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.568 HD12 ' HA ' ' A' ' 667' ' ' LYS . 32.0 mt -54.23 -49.35 69.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.889 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 31.2 tp -74.01 -52.02 14.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.91 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . 0.435 ' O ' ' N ' ' A' ' 674' ' ' GLY . 19.0 mt-10 -55.09 -65.77 0.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.895 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . 0.415 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 16.1 mmp_? -39.49 -28.54 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.838 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . 0.435 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 93.99 42.85 3.97 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.511 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.454 HG21 HD23 ' A' ' 670' ' ' LEU . 53.0 t -71.43 94.6 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-O 120.874 0.368 . . . . 0.0 111.131 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 57.7 m -58.83 125.41 23.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.85 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -64.72 -32.2 73.76 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.088 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -83.81 34.72 0.5 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.919 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.3 t -125.9 -175.03 3.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.897 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . 0.654 HG23 ' H ' ' A' ' 683' ' ' LYS . 12.9 t -106.17 158.76 16.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.13 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 50.1 t-105 -63.28 -38.07 89.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.887 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -54.28 -57.13 12.38 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.911 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.654 ' H ' HG23 ' A' ' 680' ' ' THR . 5.9 mtpm? -60.64 -59.62 5.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.905 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -52.55 -34.69 51.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.861 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 8.3 tp -59.11 -62.1 2.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.913 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.73 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.5 p-80 -50.58 -35.06 28.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.848 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.584 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 44.0 mttp -63.87 -40.03 95.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.911 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 12.0 pt -105.22 13.9 7.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.137 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.73 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.1 p -79.81 -24.32 12.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.161 179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.471 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 12.2 p90 -75.42 -44.35 44.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.852 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.471 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 7.3 t70 -53.13 139.42 45.08 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.619 0.723 . . . . 0.0 110.832 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.412 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.2 Cg_endo -69.77 -34.77 13.87 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.715 2.277 . . . . 0.0 112.345 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.527 ' HA ' HD12 ' A' ' 696' ' ' LEU . 36.6 mtm180 -58.41 -17.45 20.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.896 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -66.61 -15.55 63.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.892 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 27.8 mt -103.65 -12.31 17.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.926 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 693' ' ' ARG . 64.7 mt -62.42 -52.76 62.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.901 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.747 HD12 ' HB2' ' A' ' 666' ' ' PHE . 30.6 mt -84.67 148.05 26.61 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -56.22 162.47 3.03 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.634 0.73 . . . . 0.0 110.91 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . 0.555 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.8 Cg_endo -69.7 -32.12 19.43 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.731 2.287 . . . . 0.0 112.352 179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 44.1 mttt -72.29 -46.81 54.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.899 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -60.34 -51.76 68.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.92 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.555 HH21 ' N ' ' A' ' 699' ' ' PRO . 44.6 mtm180 -39.27 -45.38 1.39 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.9 -179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 14.2 tptm -70.91 -43.49 68.15 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.907 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -60.89 -59.54 5.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.94 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.8 t -54.65 -41.45 55.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.114 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.566 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 5.3 t80 -60.18 -48.33 82.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -54.02 -47.29 71.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.803 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -65.95 -41.26 91.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.892 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.527 ' CZ ' ' HG3' ' A' ' 713' ' ' ARG . 12.6 t80 -61.82 -47.9 83.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.892 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.566 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 92.9 t -59.46 -43.99 91.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.1 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -57.31 -49.2 76.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.915 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 13.8 p -64.63 -41.46 96.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.128 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.527 ' HG3' ' CZ ' ' A' ' 709' ' ' TYR . 3.4 mmp_? -64.63 -36.62 84.83 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.888 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -74.46 -51.01 16.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.113 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -56.44 -41.89 77.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.866 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -84.56 28.54 0.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.846 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -129.41 139.59 51.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.906 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -84.12 156.71 22.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.878 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 6.3 tpp85 -119.4 134.92 54.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.884 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 1.2 t -48.03 158.75 0.22 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.855 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -49.79 144.37 9.69 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.49 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 176.15 7.14 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.674 2.25 . . . . 0.0 112.338 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 87.2 p -173.73 171.65 3.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.886 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 23.1 t -84.51 92.77 8.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.868 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.481 -179.996 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 N-CA-C 112.49 -0.244 . . . . 0.0 112.49 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 48.3 t -91.45 159.54 15.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.858 0.361 . . . . 0.0 110.859 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 42.1 t -119.62 -47.94 2.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.892 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 149.79 127.11 1.49 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.508 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 49.9 m -134.22 122.63 23.05 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.895 0.378 . . . . 0.0 110.826 -179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 35.2 p -90.51 -60.89 1.8 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.889 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 66.06 81.88 0.13 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.512 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -106.05 101.98 11.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.782 0.325 . . . . 0.0 111.092 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 46.8 ttm-85 -132.73 106.05 7.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.872 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -90.39 41.01 1.03 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.843 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -126.96 151.03 49.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.911 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -101.75 34.7 2.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.103 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 68.7 mt -102.49 103.32 14.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.166 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 92.9 t -103.0 124.59 38.0 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.627 0.727 . . . . 0.0 111.097 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.529 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo -69.77 163.21 39.12 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.68 2.253 . . . . 0.0 112.347 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.444 HD12 ' HE ' ' A' ' 662' ' ' ARG . 10.4 tp -58.47 -48.62 80.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -55.36 -37.51 67.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.877 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.529 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -63.76 -66.1 0.59 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.124 179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.802 ' HG3' HD21 ' A' ' 697' ' ' LEU . 11.2 ptt180 -51.5 -48.22 62.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.915 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.646 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.0 mtt -56.08 -47.58 77.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.906 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -52.59 -45.62 66.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.912 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -58.28 -62.35 1.9 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.926 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.49 ' CE2' HD11 ' A' ' 670' ' ' LEU . 22.9 t80 -45.1 -55.61 5.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.892 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 32.8 tttm -54.74 -48.11 72.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.882 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -47.84 -41.58 24.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.874 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.405 ' O ' ' C ' ' A' ' 670' ' ' LEU . 5.5 mtm -67.53 -63.96 0.95 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.883 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.49 HD11 ' CE2' ' A' ' 666' ' ' PHE . 44.6 mt -38.01 -34.85 0.13 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.916 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 15.9 tp -83.25 -56.03 4.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -54.71 -64.32 0.87 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.904 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . 0.405 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 2.5 mmp_? -44.38 -29.68 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.897 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 90.29 33.22 8.88 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.473 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.798 HG13 ' CD ' ' A' ' 684' ' ' GLU . 43.1 t -56.9 116.29 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 0.0 111.135 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 58.1 m -75.3 144.92 42.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.888 -179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . 0.425 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -82.68 -28.98 30.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.076 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -77.33 -2.06 33.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.853 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.2 m -90.57 -177.84 5.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.862 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 65.8 p -104.46 160.88 14.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.183 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.62 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 29.7 t-105 -64.75 -27.08 68.65 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.882 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -61.47 -58.83 6.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.868 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.44 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 17.0 mttm -55.73 -58.98 5.56 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.91 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.798 ' CD ' HG13 ' A' ' 675' ' ' VAL . 38.1 mm-40 -56.19 -44.85 79.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.869 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.62 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 6.4 tp -46.55 -62.26 1.45 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.929 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.493 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.5 p-80 -58.63 -30.62 67.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.868 179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 43.5 mttm -69.34 -20.99 63.86 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.883 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 30.0 pt -122.68 8.31 5.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.189 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.493 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -77.7 -29.0 15.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.156 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.462 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 12.0 p90 -70.56 -44.43 67.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.915 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.462 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.6 t70 -53.22 139.76 45.19 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.573 0.702 . . . . 0.0 110.911 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.3 Cg_endo -69.67 -34.29 15.19 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.713 2.275 . . . . 0.0 112.369 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.588 ' HA ' HD12 ' A' ' 696' ' ' LEU . 16.5 mtm-85 -56.63 -24.39 47.8 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.874 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.45 ' CZ ' ' HD2' ' A' ' 702' ' ' ARG . 22.0 t80 -65.92 -17.88 64.96 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.888 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 15.8 mt -107.19 23.13 14.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.946 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 693' ' ' ARG . 78.5 mt -104.22 -29.5 10.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.89 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.802 HD21 ' HG3' ' A' ' 662' ' ' ARG . 26.7 mt -102.84 151.22 22.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.897 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 23.4 m-20 -50.74 161.85 0.62 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.635 0.731 . . . . 0.0 110.892 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . 0.403 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 54.1 Cg_endo -69.74 -37.1 9.69 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.725 2.283 . . . . 0.0 112.347 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -72.19 -39.28 68.75 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.916 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.451 ' O ' ' C ' ' A' ' 702' ' ' ARG . 35.7 mm-40 -59.88 -53.94 51.96 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.904 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.451 ' C ' ' O ' ' A' ' 701' ' ' GLU . 29.0 mtm105 -34.1 -48.03 0.3 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.914 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 16.5 tptt -72.35 -43.74 63.62 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.953 179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . 0.437 ' N ' ' O ' ' A' ' 701' ' ' GLU . 29.1 mt-30 -57.28 -56.92 15.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.908 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.72 -48.59 88.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.148 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.633 ' O ' HG23 ' A' ' 710' ' ' VAL . 52.7 t80 -57.2 -36.73 71.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.863 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -64.87 -51.5 61.65 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.864 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . 0.48 ' O ' HG23 ' A' ' 712' ' ' THR . 87.8 mm-40 -58.2 -36.34 72.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . . . . . . . . . 19.8 t80 -67.18 -41.48 85.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.974 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.633 HG23 ' O ' ' A' ' 706' ' ' PHE . 96.7 t -69.42 -39.3 78.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.151 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 17.1 tttm -62.99 -40.58 98.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.882 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . 0.48 HG23 ' O ' ' A' ' 708' ' ' GLN . 73.0 p -75.13 -38.59 61.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.13 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 5.8 mmm180 -60.23 -36.29 77.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . 0.418 ' O ' ' N ' ' A' ' 717' ' ' GLU . . . -83.93 -58.88 2.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.111 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -47.9 -26.53 1.74 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.922 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -94.61 26.41 3.49 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.886 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 714' ' ' ALA . 3.4 tm-20 -54.83 91.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.916 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 19.2 ptt180 -84.92 161.93 19.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.885 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 13.5 ttm180 -43.12 152.46 0.12 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.874 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 23.3 m -47.78 128.48 13.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.812 -179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 165.4 76.09 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.455 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 157.94 58.7 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.703 2.268 . . . . 0.0 112.359 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 9.8 t -128.18 118.78 23.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.901 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . 0.448 ' O ' ' C ' ' A' ' 725' ' ' GLY . 83.3 p -55.33 -44.57 75.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.851 -179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . 0.448 ' C ' ' O ' ' A' ' 724' ' ' SER . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.496 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.384 0 N-CA-C 112.506 -0.237 . . . . 0.0 112.506 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 1.1 t -127.93 102.73 6.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.892 0.377 . . . . 0.0 110.822 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 16.7 p -72.66 -15.6 61.71 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.853 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 62.92 108.62 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.472 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 3.4 m -112.2 86.03 2.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.865 0.364 . . . . 0.0 110.851 -179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 2.3 m -153.61 172.42 17.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.833 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 142.46 82.02 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.481 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -101.83 116.62 33.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.787 0.327 . . . . 0.0 111.071 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 6.3 ptt85 -105.33 124.52 49.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.882 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -79.41 -65.81 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.913 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 9.5 mmp_? -96.83 -179.14 4.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.882 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -95.75 53.29 1.41 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.089 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 27.5 mt -123.7 88.32 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.106 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . 0.63 ' CG2' ' HB3' ' A' ' 661' ' ' ALA . 4.3 p -74.96 130.39 81.08 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.574 0.702 . . . . 0.0 111.145 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.529 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.1 Cg_endo -69.81 154.98 66.92 Favored 'Trans proline' 0 C--O 1.232 0.222 0 C-N-CA 122.663 2.242 . . . . 0.0 112.289 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.425 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 15.2 tp -49.93 -49.74 48.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.87 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -54.35 -41.16 68.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.918 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.63 ' HB3' ' CG2' ' A' ' 657' ' ' VAL . . . -62.31 -70.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.091 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.644 ' HG3' HD21 ' A' ' 697' ' ' LEU . 7.6 ptt180 -48.46 -46.76 38.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.878 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 7.3 mtt -57.5 -46.53 83.64 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.846 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 3.7 mmmm -53.43 -45.83 69.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.887 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -58.16 -60.91 3.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.897 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.639 ' HB2' HD12 ' A' ' 697' ' ' LEU . 18.0 t80 -48.72 -58.74 4.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.922 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.698 ' HA ' HD12 ' A' ' 670' ' ' LEU . 51.5 tttt -51.84 -37.45 52.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.919 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -58.71 -54.18 49.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.896 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.531 ' CE ' ' CE1' ' A' ' 666' ' ' PHE . 2.7 ptt? -65.42 -37.07 85.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.908 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.698 HD12 ' HA ' ' A' ' 667' ' ' LYS . 30.0 mt -52.0 -50.62 60.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.898 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 37.7 tp -74.74 -47.36 31.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.919 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -56.74 -66.08 0.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.906 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -42.64 -25.64 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.853 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 85.98 44.34 6.04 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.479 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.558 HG13 ' CG ' ' A' ' 684' ' ' GLU . 25.8 t -68.37 109.62 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.784 0.326 . . . . 0.0 111.1 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 24.5 m -67.51 136.45 54.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.831 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . 0.673 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -69.58 -55.74 9.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.125 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -54.27 -30.81 51.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.852 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.9 m -55.83 167.14 0.61 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.863 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 44.8 p -93.88 153.45 18.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.154 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 33.9 t-105 -57.47 -26.1 60.72 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.933 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.25 -60.24 3.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.881 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -54.03 -59.07 5.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.87 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.558 ' CG ' HG13 ' A' ' 675' ' ' VAL . 59.6 mm-40 -54.39 -43.98 71.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.882 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 7.0 tp -48.23 -57.63 5.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.605 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.5 p-80 -59.29 -33.74 71.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.839 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.475 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 24.5 mttp -65.29 -26.08 67.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 16.4 pt -117.29 7.87 7.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.153 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.605 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -76.88 -35.91 24.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.11 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.451 ' CE1' ' O ' ' A' ' 687' ' ' LYS . 47.9 p90 -83.41 13.84 4.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' A' ' 693' ' ' ARG . 2.9 t70 -102.46 143.61 26.95 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.614 0.721 . . . . 0.0 110.843 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.409 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.74 -46.81 1.1 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.688 2.259 . . . . 0.0 112.332 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.514 ' HA ' HD12 ' A' ' 696' ' ' LEU . 54.8 mtm180 -53.96 -26.06 23.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.9 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.607 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 0.7 OUTLIER -66.48 -27.92 68.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.938 -179.858 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.9 mt -89.0 2.85 53.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.964 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.514 HD12 ' HA ' ' A' ' 693' ' ' ARG . 94.8 mt -86.98 -42.22 13.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.912 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.644 HD21 ' HG3' ' A' ' 662' ' ' ARG . 29.7 mt -91.17 144.46 25.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.891 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -51.41 161.85 0.75 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.58 0.705 . . . . 0.0 110.923 179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -35.1 13.31 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.682 2.255 . . . . 0.0 112.34 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -72.09 -45.95 58.69 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.88 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -59.38 -45.55 91.13 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.839 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.607 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 42.0 mtt180 -43.45 -45.14 6.21 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.822 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -72.11 -44.68 62.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.875 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 8.1 mm100 -57.6 -60.0 4.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.93 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 72.2 t -55.21 -47.12 77.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.159 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.577 ' O ' HG23 ' A' ' 710' ' ' VAL . 37.2 t80 -56.59 -41.25 76.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.897 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -59.12 -49.54 77.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.848 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -62.04 -42.63 99.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.93 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.586 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 7.0 t80 -58.75 -37.67 76.75 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.958 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.673 HG13 ' HB1' ' A' ' 677' ' ' ALA . 96.8 t -69.88 -45.89 75.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.162 179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 26.9 tttm -51.95 -51.94 53.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.903 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 3.9 p -68.81 -31.1 69.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.175 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.586 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 3.2 mmm180 -65.96 -33.76 76.55 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.924 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -82.32 -46.84 13.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.138 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' A' ' 717' ' ' GLU . 4.5 pt-20 -54.88 -43.18 72.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.941 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . 0.417 ' N ' ' CG ' ' A' ' 715' ' ' GLU . 16.4 tm-20 -39.67 -26.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.923 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . 0.466 ' N ' ' O ' ' A' ' 715' ' ' GLU . 0.0 OUTLIER -67.57 106.14 2.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.889 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . 0.441 ' C ' ' O ' ' A' ' 717' ' ' GLU . 8.7 ttt180 -34.35 143.48 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 45.7 ttp180 -120.79 142.64 49.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.863 -179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 28.7 t -46.04 101.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 167.67 151.94 7.25 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.499 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -11.59 31.19 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.691 2.261 . . . . 0.0 112.33 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 57.9 m -38.67 130.34 1.4 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.831 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 22.5 t -144.82 158.27 43.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.845 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.475 179.999 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.329 0 N-CA-C 112.514 -0.234 . . . . 0.0 112.514 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 46.0 m -101.29 42.06 1.15 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.898 0.38 . . . . 0.0 110.858 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 4.4 t -101.64 -56.52 2.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.832 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 113.59 95.06 2.12 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.5 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 4.5 m -96.18 98.79 10.6 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.87 0.367 . . . . 0.0 110.861 -179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 40.5 t -164.29 139.45 5.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.841 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 155.74 102.36 0.2 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.49 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -93.41 99.75 12.19 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.785 0.326 . . . . 0.0 111.098 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 8.3 ptt-85 -75.07 136.03 41.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.869 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 654' ' ' ARG . 16.4 pt-20 -121.78 -47.53 2.19 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.874 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . 0.409 ' N ' ' HG3' ' A' ' 653' ' ' GLU . 23.9 mmt180 -97.45 161.26 13.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.858 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -87.34 80.87 8.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.074 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 65.9 mt -138.11 115.56 12.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.094 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . 0.422 ' HA ' ' HD2' ' A' ' 658' ' ' PRO . 88.1 t -101.49 98.1 8.74 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.604 0.716 . . . . 0.0 111.146 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.539 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.3 Cg_endo -69.78 152.24 69.17 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.664 2.243 . . . . 0.0 112.352 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.429 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 13.2 tp -49.25 -44.51 43.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -58.95 -42.26 89.41 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.924 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.539 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -61.0 -65.06 0.75 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.065 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.475 ' HG3' HD21 ' A' ' 697' ' ' LEU . 10.3 ptt180 -53.18 -54.33 37.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.904 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.521 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.7 mtt -51.47 -46.06 62.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.846 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.4 -43.4 71.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.899 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 13.4 mm-40 -59.55 -58.76 7.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.894 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.685 ' HB2' HD12 ' A' ' 697' ' ' LEU . 26.9 t80 -50.64 -51.31 50.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.89 -179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.434 ' HA ' HD12 ' A' ' 670' ' ' LEU . 27.4 tttt -60.89 -35.35 76.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.927 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -61.8 -56.61 17.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.864 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -59.87 -36.24 76.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.887 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.564 HD11 ' CE2' ' A' ' 666' ' ' PHE . 34.6 mt -56.95 -48.59 77.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.906 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 24.7 tp -71.77 -45.23 62.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' A' ' 674' ' ' GLY . 23.2 mt-10 -61.67 -65.81 0.63 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 2.7 mmp_? -41.5 -24.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.887 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 86.71 46.86 5.02 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.452 -179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.44 HG13 ' CG ' ' A' ' 684' ' ' GLU . 24.4 t -72.22 106.4 2.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.829 0.347 . . . . 0.0 111.13 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 9.3 t -65.59 140.02 58.49 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.866 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . 0.4 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -78.75 -44.07 24.18 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.072 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -63.78 -20.89 66.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.4 m -69.04 -175.52 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.868 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . 0.404 HG23 ' H ' ' A' ' 683' ' ' LYS . 12.5 t -106.61 167.24 9.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.136 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.498 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 31.4 t-105 -69.13 -26.8 65.07 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.866 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -61.2 -63.01 1.43 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.875 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.404 ' H ' HG23 ' A' ' 680' ' ' THR . 5.9 mtpm? -52.67 -59.03 4.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.916 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.44 ' CG ' HG13 ' A' ' 675' ' ' VAL . 49.1 mm-40 -55.51 -44.54 76.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.881 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.498 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.3 tp -47.79 -55.99 8.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.914 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.55 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.8 p-80 -61.9 -31.82 72.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.881 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.469 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 82.5 mttt -66.66 -24.91 66.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.918 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 20.9 pt -120.68 9.01 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.103 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.55 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.0 p -75.22 -26.69 18.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.175 179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -84.65 -39.05 19.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.877 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.423 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 8.6 t70 -43.59 139.78 2.58 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.655 0.741 . . . . 0.0 110.867 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.82 -36.28 10.94 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.638 2.225 . . . . 0.0 112.357 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.644 ' HA ' HD12 ' A' ' 696' ' ' LEU . 57.0 mtm180 -65.16 -20.07 66.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.856 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.59 ' CE2' ' HD2' ' A' ' 702' ' ' ARG . 0.6 OUTLIER -66.03 -21.29 66.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.926 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 52.1 mt -93.89 -13.76 26.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.905 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.644 HD12 ' HA ' ' A' ' 693' ' ' ARG . 63.7 mt -67.47 -52.05 43.94 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.944 179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.685 HD12 ' HB2' ' A' ' 666' ' ' PHE . 33.3 mt -79.72 147.23 32.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.91 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -51.51 162.54 0.69 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.627 0.727 . . . . 0.0 110.89 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . 0.402 ' HA ' ' CZ ' ' A' ' 702' ' ' ARG . 53.5 Cg_endo -69.75 -36.61 10.51 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.683 2.255 . . . . 0.0 112.335 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -72.19 -41.68 66.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.876 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 15.7 mt-10 -58.68 -51.22 70.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.889 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.59 ' HD2' ' CE2' ' A' ' 694' ' ' TYR . 24.7 mtm105 -34.23 -50.88 0.42 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.849 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.4 tptm -70.56 -46.2 63.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.886 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 7.2 mm-40 -55.47 -61.16 2.53 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.926 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 65.9 t -54.06 -45.19 65.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.086 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.68 -52.42 63.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.866 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -51.13 -47.19 62.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -63.4 -39.82 95.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.913 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.57 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 20.3 t80 -63.69 -49.63 72.38 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.921 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.4 HG13 ' HB1' ' A' ' 677' ' ' ALA . 82.4 t -55.93 -42.49 71.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.128 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 33.6 tttp -60.3 -46.17 90.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.899 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 15.8 p -65.8 -37.33 86.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.119 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.57 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.3 mmm180 -67.04 -28.73 68.46 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.882 -179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -83.18 -46.91 12.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.104 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -57.94 -38.45 75.98 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.91 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -90.1 29.77 1.18 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.889 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -47.89 112.78 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.897 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 31.4 mmt180 -42.45 -51.54 4.96 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -74.34 86.33 1.98 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.882 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 60.6 p -150.03 154.81 38.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.854 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -67.27 -77.45 0.31 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.481 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 120.85 7.56 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.662 2.242 . . . . 0.0 112.299 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 3.1 m -91.03 144.01 26.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.843 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 47.1 t -157.73 136.54 11.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.81 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.468 -179.995 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 16.0 t -102.05 102.86 13.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.93 0.395 . . . . 0.0 110.82 -179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 18.2 m -68.47 113.89 6.42 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.843 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 69.09 125.79 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.498 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 62.8 p -91.48 -43.82 9.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.864 0.364 . . . . 0.0 110.836 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 83.6 p -159.08 144.41 16.09 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.839 -179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -117.85 96.99 0.71 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.423 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -80.16 167.74 19.98 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.746 0.307 . . . . 0.0 111.132 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 9.7 mmp_? -111.5 43.36 1.52 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.891 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -131.77 168.84 17.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 18.1 tpp180 -119.31 -57.57 1.99 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.856 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -98.5 41.6 1.13 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.1 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 48.6 mm -126.41 81.94 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.143 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . 0.412 ' H ' HG13 ' A' ' 657' ' ' VAL . 2.2 m -49.63 149.95 3.94 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.604 0.716 . . . . 0.0 111.128 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.556 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.9 Cg_endo -69.75 162.35 42.4 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.674 2.249 . . . . 0.0 112.34 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 31.4 tp -54.69 -51.11 66.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.933 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . 0.467 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 12.0 mm-40 -55.64 -30.5 61.09 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.92 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.556 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -71.84 -70.99 0.3 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.126 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.75 ' CZ ' HD23 ' A' ' 697' ' ' LEU . 0.1 OUTLIER -48.35 -52.69 20.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.897 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.606 ' HA ' HD11 ' A' ' 697' ' ' LEU . 6.0 mtt -54.84 -48.48 72.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . 0.467 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 1.7 mmmm -53.16 -37.45 61.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.916 179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 63.7 mt-30 -64.01 -56.42 15.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.906 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.65 ' HB2' HD12 ' A' ' 697' ' ' LEU . 29.4 t80 -52.31 -47.61 65.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.892 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.504 ' HA ' HD12 ' A' ' 670' ' ' LEU . 41.3 tttt -67.26 -34.26 77.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.92 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -62.99 -44.76 95.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.877 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.431 ' O ' ' CG ' ' A' ' 673' ' ' ARG . 2.8 ptt? -70.35 -32.36 70.03 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.883 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 667' ' ' LYS . 40.8 mt -60.85 -49.82 75.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.892 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.5 tp -70.89 -55.91 7.41 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.942 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . 0.405 ' C ' ' N ' ' A' ' 674' ' ' GLY . 15.9 mt-10 -49.31 -63.58 1.06 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.93 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . 0.431 ' CG ' ' O ' ' A' ' 669' ' ' MET . 4.6 mmp_? -45.67 -21.31 0.11 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.843 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . 0.405 ' N ' ' C ' ' A' ' 672' ' ' GLU . . . 85.7 46.02 5.57 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.486 -179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.881 HG13 ' CD ' ' A' ' 684' ' ' GLU . 70.9 t -78.32 103.56 5.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 120.807 0.337 . . . . 0.0 111.142 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 16.4 m -67.7 158.51 32.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.871 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . 0.445 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -88.57 -36.81 16.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.072 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -66.55 -10.08 41.5 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.919 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.1 m -82.7 175.49 10.1 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.822 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 59.4 p -102.44 178.33 4.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.172 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.462 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 50.6 t-105 -76.08 -25.22 55.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.933 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -67.15 -56.76 8.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.883 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.498 ' O ' ' CD2' ' A' ' 686' ' ' HIS . 59.6 mttm -53.94 -59.03 5.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.875 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.881 ' CD ' HG13 ' A' ' 675' ' ' VAL . 64.0 mm-40 -57.77 -45.8 85.46 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.899 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.462 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 7.9 tp -45.27 -53.38 8.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.921 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.645 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.7 p80 -68.41 -28.65 67.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.897 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.562 ' O ' ' CZ ' ' A' ' 690' ' ' PHE . 37.9 mttm -68.96 -21.12 64.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 26.1 pt -121.96 -0.38 7.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.115 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 686' ' ' HIS . 8.7 p -62.82 -25.32 38.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.13 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.562 ' CZ ' ' O ' ' A' ' 687' ' ' LYS . 18.6 p90 -93.59 11.66 28.01 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.835 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.429 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.5 t70 -99.3 139.85 21.24 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.596 0.712 . . . . 0.0 110.877 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.429 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.78 -31.78 19.78 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.688 2.259 . . . . 0.0 112.302 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 22.4 mtm-85 -67.21 -21.49 65.76 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.841 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.473 ' CD1' ' O ' ' A' ' 694' ' ' TYR . 10.6 t80 -68.55 -5.53 20.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 13.1 mt -120.91 14.8 11.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.944 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 55.5 mt -95.51 -26.18 15.91 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.939 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.75 HD23 ' CZ ' ' A' ' 662' ' ' ARG . 29.8 mt -112.12 155.56 23.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.882 179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . 0.422 ' HB3' ' HD2' ' A' ' 699' ' ' PRO . 0.2 OUTLIER -54.47 158.52 4.02 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.603 0.716 . . . . 0.0 110.884 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . 0.422 ' HD2' ' HB3' ' A' ' 698' ' ' ASN . 53.2 Cg_endo -69.82 -33.73 15.77 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.626 2.217 . . . . 0.0 112.345 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.9 mmtm -72.69 -46.01 55.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.945 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' A' ' 704' ' ' GLN . 0.4 OUTLIER -62.35 -54.52 39.3 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.877 179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.528 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 57.0 mtm180 -34.21 -48.29 0.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.902 -179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.57 -41.34 69.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.901 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 701' ' ' GLU . 21.5 mm-40 -60.39 -56.63 19.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.901 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 33.2 t -57.31 -43.25 81.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.116 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.495 ' O ' HG23 ' A' ' 710' ' ' VAL . 21.8 t80 -62.17 -37.93 87.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.891 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -60.86 -49.86 75.77 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.863 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -61.44 -35.34 77.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.895 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.539 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 0.8 OUTLIER -65.65 -35.98 82.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.954 -179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 706' ' ' PHE . 93.5 t -70.95 -51.3 36.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.135 179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 12.9 ttmt -56.8 -35.81 69.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.918 179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 15.6 p -75.1 -39.78 60.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.184 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.539 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 2.4 mmp_? -64.32 -35.66 81.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.85 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -82.88 -55.19 4.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.112 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 2.0 pp20? -52.57 -28.82 22.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.875 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 -93.72 25.45 3.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.919 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 24.9 tp10 -65.83 83.31 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.878 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 47.5 mtt180 -86.2 149.2 25.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.876 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -110.35 -62.36 1.53 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.916 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 4.2 m -94.09 168.91 10.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.891 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -65.04 146.24 50.05 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.497 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.77 134.51 28.13 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.706 2.271 . . . . 0.0 112.304 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 90.8 p -111.83 -12.99 13.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.866 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 45.5 m -123.88 151.19 43.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.852 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.284 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.499 179.995 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 5.7 t -88.06 133.88 33.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.893 0.378 . . . . 0.0 110.834 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 15.0 t -160.99 153.25 20.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.858 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 149.73 -52.85 0.52 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.513 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 53.7 p 46.31 41.23 8.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.87 0.367 . . . . 0.0 110.828 -179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 4.4 t 69.74 43.25 0.98 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.897 -179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -100.21 79.87 0.47 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.487 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -134.81 129.74 35.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.796 0.331 . . . . 0.0 111.097 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 39.6 mtp180 -60.8 -66.18 0.57 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.873 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . 0.503 ' OE2' ' CZ ' ' A' ' 654' ' ' ARG . 5.1 tp10 -100.51 174.53 6.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.931 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . 0.503 ' CZ ' ' OE2' ' A' ' 653' ' ' GLU . 0.0 OUTLIER -93.66 -14.53 26.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.896 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -130.67 22.05 5.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.101 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 63.1 mt -140.17 123.58 17.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.106 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 25.7 m -65.81 149.81 97.06 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.629 0.728 . . . . 0.0 111.164 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 158.45 56.92 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.724 2.283 . . . . 0.0 112.338 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.43 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 18.6 tp -48.05 -49.05 32.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.918 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -55.53 -41.13 72.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.906 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -61.47 -67.64 0.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.133 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.727 ' HG3' HD21 ' A' ' 697' ' ' LEU . 7.9 ptt180 -51.14 -46.4 61.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.869 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.58 ' HA ' HD11 ' A' ' 697' ' ' LEU . 6.7 mtt -58.83 -49.47 77.6 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.895 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 16.3 mtmt -49.62 -46.24 49.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . 0.471 ' OE1' ' CD1' ' A' ' 696' ' ' LEU . 86.4 mt-30 -59.33 -64.1 1.06 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.885 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.736 ' HB2' HD12 ' A' ' 697' ' ' LEU . 27.6 t80 -41.52 -56.95 2.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.88 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 35.1 tttp -54.94 -47.41 74.51 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.887 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -50.59 -33.17 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.854 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.423 ' O ' ' C ' ' A' ' 670' ' ' LEU . 5.4 mtm -74.58 -65.79 0.82 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' A' ' 669' ' ' MET . 83.6 mt -35.3 -40.91 0.15 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.89 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.9 tp -76.67 -58.15 3.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.934 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . 0.447 ' O ' ' N ' ' A' ' 674' ' ' GLY . 8.3 mm-40 -57.78 -64.3 0.95 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.862 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . 0.434 ' C ' ' O ' ' A' ' 672' ' ' GLU . 4.2 mmp_? -35.02 -34.53 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.873 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . 0.447 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 98.03 42.27 3.09 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.419 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.631 HG13 ' HG3' ' A' ' 684' ' ' GLU . 94.9 t -75.56 136.94 23.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.844 0.354 . . . . 0.0 111.156 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 15.9 m -103.7 121.89 43.9 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.841 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . 0.526 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -45.98 -57.88 4.04 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.121 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -46.46 -30.24 2.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.902 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.87 160.72 11.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.854 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . 0.517 HG23 ' H ' ' A' ' 683' ' ' LYS . 14.4 t -82.33 -177.74 6.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.146 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.558 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 19.3 t-105 -84.3 -34.52 23.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.938 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -64.32 -59.86 3.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.517 ' H ' HG23 ' A' ' 680' ' ' THR . 12.4 mtpt -46.25 -58.94 3.23 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.915 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.631 ' HG3' HG13 ' A' ' 675' ' ' VAL . 31.9 mm-40 -62.64 -47.58 83.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.852 179.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.558 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 7.3 tp -43.16 -48.54 6.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.92 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.693 ' O ' HG12 ' A' ' 689' ' ' VAL . 0.9 OUTLIER -70.42 -38.43 74.6 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.85 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.517 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 44.3 mttp -60.56 -19.56 57.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.835 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 19.5 pt -115.39 -16.78 8.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.147 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.2 p -55.26 -32.41 28.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.143 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 2.9 p90 -62.74 -36.41 82.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.861 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.425 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 8.5 t70 -64.0 139.74 97.73 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.609 0.719 . . . . 0.0 110.848 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.8 -36.92 9.82 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.708 2.272 . . . . 0.0 112.315 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.47 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 22.3 mtm-85 -56.39 -19.72 16.18 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.852 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.614 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 27.5 t80 -66.76 -18.5 65.4 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.894 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 20.1 mt -96.3 -3.85 43.22 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.471 ' CD1' ' OE1' ' A' ' 665' ' ' GLN . 83.0 mt -77.09 -43.72 33.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.911 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.736 HD12 ' HB2' ' A' ' 666' ' ' PHE . 31.9 mt -89.88 152.24 21.35 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.904 179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 24.2 m-20 -61.84 162.1 18.56 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.663 0.744 . . . . 0.0 110.849 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . 0.422 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.4 Cg_endo -69.7 -34.06 15.57 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.694 2.262 . . . . 0.0 112.364 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 29.3 mttm -72.13 -47.07 53.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.908 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.449 ' O ' ' C ' ' A' ' 702' ' ' ARG . 24.4 mt-10 -60.75 -56.53 20.1 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.903 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.614 ' NH1' ' CE2' ' A' ' 694' ' ' TYR . 46.0 mtm180 -34.59 -45.41 0.24 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.849 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.34 -45.76 62.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.865 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . 0.435 ' N ' ' O ' ' A' ' 701' ' ' GLU . 11.2 mm100 -57.12 -50.35 73.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.914 179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.64 -39.24 83.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.11 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.831 ' O ' HG23 ' A' ' 710' ' ' VAL . 24.4 t80 -65.22 -36.84 85.41 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.859 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -64.68 -52.39 57.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.88 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . 0.466 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 5.5 pt20 -60.67 -36.65 79.27 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.913 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.488 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 11.7 t80 -66.76 -39.5 87.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.924 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.831 HG23 ' O ' ' A' ' 706' ' ' PHE . 99.6 t -64.55 -45.63 95.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.196 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . 0.406 ' N ' ' HD2' ' A' ' 711' ' ' LYS . 0.9 OUTLIER -59.38 -52.22 66.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.9 179.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 18.4 p -60.16 -37.79 81.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.157 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.488 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 3.4 mmp_? -65.11 -38.28 90.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.902 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -74.12 -54.95 6.71 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.142 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -51.65 -39.32 57.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.868 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -87.55 30.35 0.81 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.871 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -105.16 99.49 9.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.841 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -104.39 -41.54 5.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.852 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 18.9 tpp180 -93.36 109.79 21.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.835 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 40.5 m -100.02 166.2 11.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.87 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -69.59 146.98 44.6 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.441 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 -37.62 8.87 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.679 2.253 . . . . 0.0 112.319 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 6.1 t -137.99 156.56 47.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.847 -179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 50.3 m -80.38 146.18 31.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.857 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.379 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.493 -179.981 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 6.6 t -104.0 166.33 10.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.881 0.372 . . . . 0.0 110.842 -179.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 71.4 m -132.4 -49.39 0.92 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.896 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 140.37 168.04 11.23 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.473 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 81.1 p -150.07 164.94 34.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.886 0.374 . . . . 0.0 110.868 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 60.7 p -108.82 -42.96 4.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.837 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 76.75 123.16 0.2 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.469 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -112.34 87.21 2.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.75 0.309 . . . . 0.0 111.112 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 5.9 ptp85 -134.44 174.79 10.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.883 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -95.66 -58.28 2.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.894 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -117.11 134.62 54.53 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.852 -179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -66.64 96.07 0.37 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.077 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 4.4 mm -131.19 96.05 2.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.104 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 15.8 m -56.27 150.43 32.23 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.635 0.731 . . . . 0.0 111.135 179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 160.66 48.89 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.629 2.219 . . . . 0.0 112.366 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 25.3 tp -51.14 -48.57 61.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.938 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . 0.485 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 14.1 pt-20 -56.03 -36.19 67.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.87 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.41 -71.07 0.22 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.148 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.454 ' HE ' HD23 ' A' ' 697' ' ' LEU . 3.3 ptm180 -46.53 -56.98 5.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.883 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.464 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.9 mtt -50.69 -49.8 56.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.902 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . 0.485 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 2.5 mmmm -51.74 -41.09 61.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.91 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -60.8 -56.46 20.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.883 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.635 ' HB2' HD12 ' A' ' 697' ' ' LEU . 24.8 t80 -51.73 -55.55 19.0 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.83 -179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 10.8 tttm -54.89 -35.86 64.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.928 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -60.14 -47.58 85.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.856 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.526 ' CE ' ' CE1' ' A' ' 666' ' ' PHE . 2.9 ptt? -72.75 -36.4 67.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.894 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.533 HD11 ' CE2' ' A' ' 666' ' ' PHE . 33.1 mt -52.42 -51.19 60.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.965 179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 23.3 tp -76.96 -53.62 7.61 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.939 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 60.0 mm-40 -49.64 -61.44 2.11 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.874 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 15.6 mmp_? -49.42 -19.57 0.56 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.887 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 82.09 44.34 7.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.45 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.44 HG13 ' CG ' ' A' ' 684' ' ' GLU . 71.7 t -70.13 103.54 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 120.839 0.352 . . . . 0.0 111.136 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 19.4 t -63.0 145.54 55.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.824 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . 0.487 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -81.58 -36.85 28.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.1 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -72.75 -9.11 58.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.865 -179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.1 m -80.94 168.13 19.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.885 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 15.2 t -95.81 173.62 7.37 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.182 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.467 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 57.0 t-105 -70.64 -30.82 67.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.876 179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -59.79 -59.16 5.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.574 ' HA ' ' CD2' ' A' ' 686' ' ' HIS . 38.5 mttm -56.78 -59.01 5.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.939 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.44 ' CG ' HG13 ' A' ' 675' ' ' VAL . 56.5 mm-40 -55.51 -39.27 70.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.872 179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.467 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 8.0 tp -53.37 -59.6 4.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.868 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.713 ' O ' HG12 ' A' ' 689' ' ' VAL . 2.0 p80 -60.02 -27.6 67.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.879 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.556 ' HG3' ' CE1' ' A' ' 686' ' ' HIS . 47.6 mttm -69.25 -34.18 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.877 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 7.5 pt -111.26 9.66 8.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.125 179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 686' ' ' HIS . 9.8 p -70.25 -32.71 51.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.117 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.447 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 5.2 p90 -77.1 -38.49 52.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.864 -179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.447 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 9.1 t70 -50.94 139.76 21.96 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.559 0.695 . . . . 0.0 110.887 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.425 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.2 Cg_endo -69.76 -37.82 8.64 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.693 2.262 . . . . 0.0 112.329 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.476 ' HA ' HD12 ' A' ' 696' ' ' LEU . 14.4 mtm-85 -58.87 -20.98 56.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.88 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.438 ' OH ' ' CD1' ' A' ' 685' ' ' LEU . 61.8 t80 -69.2 -7.76 39.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.912 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 33.2 mt -119.07 20.48 12.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.476 HD12 ' HA ' ' A' ' 693' ' ' ARG . 96.7 mt -104.57 -34.98 8.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.934 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.635 HD12 ' HB2' ' A' ' 666' ' ' PHE . 29.1 mt -101.55 144.34 30.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.92 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -48.7 161.88 0.39 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.659 0.742 . . . . 0.0 110.842 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . 0.414 ' HA ' ' NE ' ' A' ' 702' ' ' ARG . 54.3 Cg_endo -69.7 -33.88 15.89 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.693 2.262 . . . . 0.0 112.358 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 3.9 mptt -72.15 -44.96 62.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.836 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.508 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -61.28 -50.74 71.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.895 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.414 ' NE ' ' HA ' ' A' ' 699' ' ' PRO . 53.8 mtm180 -39.97 -45.28 1.86 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.89 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . 0.403 ' HD2' ' C ' ' A' ' 703' ' ' LYS . 2.0 tmmm? -71.68 -43.89 65.22 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.857 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -58.62 -58.17 9.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.0 t -57.56 -40.66 76.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.107 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.893 ' O ' HG23 ' A' ' 710' ' ' VAL . 18.5 t80 -66.78 -30.66 70.93 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.922 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . 0.428 ' C ' ' OD1' ' A' ' 707' ' ' ASP . 0.8 OUTLIER -66.44 -55.28 16.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.864 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . 0.401 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 7.0 pt20 -57.9 -41.72 83.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.936 -179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.546 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 0.8 OUTLIER -60.2 -41.01 92.09 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.953 -179.93 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.893 HG23 ' O ' ' A' ' 706' ' ' PHE . 92.8 t -63.56 -50.42 78.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.085 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 9.2 mptt -51.14 -51.62 51.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.907 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 2.3 p -60.18 -40.47 90.08 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.122 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.546 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 2.6 mmp_? -66.16 -26.96 67.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.842 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -80.15 -53.49 6.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.094 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -54.44 -39.67 67.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . 0.447 ' O ' ' C ' ' A' ' 717' ' ' GLU . 1.7 tp10 -83.99 20.63 1.49 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.877 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . 0.447 ' C ' ' O ' ' A' ' 716' ' ' GLU . 9.9 pt-20 -34.5 124.79 0.52 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.864 -179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -79.88 147.37 31.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 26.4 mtp180 -103.41 -66.18 0.96 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.855 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 44.0 t -124.71 163.1 22.78 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.879 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 168.23 159.79 14.61 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.489 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 141.23 44.91 Favored 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.718 2.278 . . . . 0.0 112.383 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 7.4 t -46.91 -57.02 5.38 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.884 -179.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 27.0 m -109.28 131.52 54.99 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.882 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.491 -179.929 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 112.501 -0.239 . . . . 0.0 112.501 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 99.4 p -156.23 165.4 36.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.927 0.394 . . . . 0.0 110.869 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 7.7 t -139.28 168.57 19.54 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.864 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . -178.71 80.67 0.06 OUTLIER Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.483 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 2.9 t -132.06 87.37 2.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.863 0.363 . . . . 0.0 110.886 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 29.0 p -64.54 175.88 1.27 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.867 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 64.07 130.99 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.514 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -139.26 170.69 15.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.77 0.319 . . . . 0.0 111.116 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -100.92 145.83 28.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.913 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -52.7 -17.07 1.14 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.874 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 1.1 mpp_? -72.45 140.59 48.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.859 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -112.62 26.66 10.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.126 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . 0.449 ' N ' HD12 ' A' ' 656' ' ' ILE . 4.9 mp -103.01 93.7 2.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.144 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 10.5 m -53.99 145.71 32.2 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.578 0.704 . . . . 0.0 111.145 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.433 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.0 Cg_endo -69.74 163.67 37.38 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.703 2.269 . . . . 0.0 112.333 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 23.7 tp -56.19 -48.71 75.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . 0.462 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 29.3 mt-10 -56.05 -32.64 64.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.848 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.433 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -69.97 -69.98 0.32 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.135 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.616 ' HG3' HD21 ' A' ' 697' ' ' LEU . 5.6 ptm180 -45.56 -48.09 14.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.855 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.701 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.5 mtt -56.39 -54.02 50.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . 0.462 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 3.3 mmpt? -48.37 -46.49 36.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.914 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -55.62 -63.37 1.19 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.929 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.734 ' HB2' HD12 ' A' ' 697' ' ' LEU . 22.8 t80 -45.38 -52.43 9.98 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.922 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 21.8 tttt -58.35 -44.22 88.67 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.861 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -51.47 -39.75 58.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.829 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 16.3 mtm -68.73 -58.6 3.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.898 179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 52.6 mt -43.11 -38.37 2.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.911 -179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 15.4 tp -80.41 -58.88 2.92 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.901 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -52.85 -64.36 0.84 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.904 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 23.2 mmt180 -46.3 -25.76 0.69 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.821 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 85.78 31.07 22.04 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.468 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.572 HG13 ' CD ' ' A' ' 684' ' ' GLU . 24.4 t -53.84 108.74 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.857 0.36 . . . . 0.0 111.142 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 8.3 t -64.55 149.71 48.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.87 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . 0.486 ' HA ' HG13 ' A' ' 710' ' ' VAL . . . -82.56 -39.82 21.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.118 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -66.53 -24.69 66.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.858 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 4.8 m -63.66 171.0 2.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.884 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . 0.625 HG22 ' HE3' ' A' ' 683' ' ' LYS . 10.8 t -100.25 166.07 11.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.142 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 52.6 t-105 -63.53 -33.32 75.33 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.897 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -58.79 -56.11 26.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.88 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.625 ' HE3' HG22 ' A' ' 680' ' ' THR . 26.6 mtmt -57.7 -59.08 5.74 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.881 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.572 ' CD ' HG13 ' A' ' 675' ' ' VAL . 56.1 mm-40 -55.99 -37.67 69.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.894 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 18.0 tp -53.75 -58.79 5.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.918 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.667 ' O ' HG12 ' A' ' 689' ' ' VAL . 2.5 p-80 -59.4 -32.03 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.822 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.549 ' O ' ' CE2' ' A' ' 690' ' ' PHE . 40.9 mttm -66.17 -29.03 69.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.868 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 20.1 pt -114.75 8.16 7.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.141 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.667 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.0 p -75.37 -34.53 30.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.127 179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.549 ' CE2' ' O ' ' A' ' 687' ' ' LYS . 51.3 p90 -81.85 12.67 3.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.896 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.426 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 11.2 t70 -101.23 139.9 20.83 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.581 0.705 . . . . 0.0 110.849 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.426 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.7 Cg_endo -69.72 -40.07 5.82 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.676 2.251 . . . . 0.0 112.347 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.434 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 16.1 mtm-85 -61.43 -30.96 70.9 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.836 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.455 ' CE1' ' HD3' ' A' ' 702' ' ' ARG . 41.2 t80 -59.91 -12.93 8.77 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.911 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.413 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 28.4 mt -108.58 19.76 19.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.911 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.434 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 97.6 mt -101.73 -48.59 4.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.876 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.734 HD12 ' HB2' ' A' ' 666' ' ' PHE . 29.0 mt -82.71 146.84 28.81 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.902 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -49.95 161.65 0.54 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.642 0.734 . . . . 0.0 110.92 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.73 -34.31 14.96 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.723 2.282 . . . . 0.0 112.356 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -72.09 -45.23 61.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.897 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.431 ' O ' ' C ' ' A' ' 702' ' ' ARG . 67.7 mm-40 -58.6 -50.77 72.62 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.9 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.455 ' HD3' ' CE1' ' A' ' 694' ' ' TYR . 68.7 mtt180 -35.82 -49.24 0.6 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.892 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 10.8 tptp -71.76 -44.83 63.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.854 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -57.46 -62.25 1.91 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.929 179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 66.7 t -53.77 -48.43 61.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.17 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.672 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 23.8 t80 -61.07 -37.46 82.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.893 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -57.27 -50.86 71.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.919 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 42.2 mm-40 -61.38 -40.5 94.55 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.886 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.566 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 4.2 t80 -63.52 -40.93 98.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.908 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.672 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 85.4 t -67.03 -53.61 32.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.153 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 13.6 mtpp -48.69 -53.55 18.36 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.852 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 1.1 p -61.27 -41.44 96.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.119 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.566 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 12.7 mmm180 -64.23 -25.79 68.22 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.869 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -78.95 -44.41 22.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.09 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -67.5 -33.4 75.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 -179.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . 0.432 ' O ' ' C ' ' A' ' 717' ' ' GLU . 3.7 tt0 -86.08 19.61 2.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.914 -179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . 0.432 ' C ' ' O ' ' A' ' 716' ' ' GLU . 9.8 pt-20 -36.21 133.62 0.47 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.86 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 22.7 ptt180 -109.28 124.4 50.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.873 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 8.6 mpt_? -42.88 112.44 0.36 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.899 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 1.7 t -72.66 107.84 5.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.851 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -82.84 -68.43 1.43 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.496 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . 0.446 ' O ' ' C ' ' A' ' 723' ' ' SER . 53.4 Cg_endo -69.8 2.67 3.34 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.664 2.243 . . . . 0.0 112.329 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . 0.446 ' C ' ' O ' ' A' ' 722' ' ' PRO . 3.9 p -34.66 124.18 0.54 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.852 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 23.4 p -129.33 178.93 6.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.881 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.38 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.498 179.999 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 N-CA-C 112.505 -0.238 . . . . 0.0 112.505 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 8.1 t 56.29 45.72 22.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.885 0.374 . . . . 0.0 110.851 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 5.7 m -130.73 156.79 44.36 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.854 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 166.19 116.43 0.36 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.498 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 52.1 p -171.84 126.45 0.59 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.88 0.372 . . . . 0.0 110.861 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 80.3 p -164.06 166.79 21.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.871 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 114.01 135.06 6.0 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.501 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -134.57 89.43 2.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.791 0.329 . . . . 0.0 111.068 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 64.9 mtp180 -127.21 139.39 52.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.917 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -125.66 96.06 4.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.877 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . 0.69 ' HG2' HD12 ' A' ' 656' ' ' ILE . 21.7 tpp180 -115.87 145.69 42.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.873 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -84.18 34.8 0.52 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.068 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . 0.69 HD12 ' HG2' ' A' ' 654' ' ' ARG . 32.6 mt -121.41 113.84 40.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.136 179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 57.6 t -113.77 122.2 35.47 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.625 0.726 . . . . 0.0 111.138 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.52 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.8 Cg_endo -69.77 146.56 60.49 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.635 2.223 . . . . 0.0 112.359 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 41.2 tp -49.26 -49.21 44.48 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.897 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 27.2 mm-40 -51.83 -39.69 59.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.878 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.52 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -66.59 -70.29 0.25 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.116 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 12.5 ptp180 -44.05 -43.34 6.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.875 -179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.623 ' HA ' HD11 ' A' ' 697' ' ' LEU . 7.6 mtt -65.29 -40.32 93.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.86 179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 17.3 mmmt -59.55 -41.41 90.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.866 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 53.2 mt-30 -65.16 -63.6 1.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.936 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.738 ' HB2' HD12 ' A' ' 697' ' ' LEU . 25.8 t80 -39.94 -57.2 1.66 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.861 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -54.64 -48.35 72.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.924 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -49.98 -35.39 24.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.848 179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.427 ' O ' ' N ' ' A' ' 672' ' ' GLU . 4.7 mtm -71.84 -65.32 0.78 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.898 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.454 HD11 ' CE2' ' A' ' 666' ' ' PHE . 49.7 mt -36.83 -38.94 0.19 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.912 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 12.6 tp -75.51 -44.68 42.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.89 179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . 0.427 ' N ' ' O ' ' A' ' 669' ' ' MET . 11.5 mm-40 -72.87 -64.55 0.94 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.892 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . 0.429 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 12.5 mmp_? -39.16 -35.68 0.25 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.847 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 98.66 28.67 7.78 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.46 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.569 HG13 ' CG ' ' A' ' 684' ' ' GLU . 38.0 t -59.43 91.78 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.847 0.356 . . . . 0.0 111.135 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 73.7 m -49.11 151.16 1.4 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.821 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -84.69 -48.11 9.79 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.127 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -56.36 -31.26 63.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.865 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -60.28 -178.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.889 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 10.9 t -104.45 -177.3 3.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.146 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.492 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 45.9 t-105 -83.05 -29.5 28.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.891 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -60.88 -60.79 3.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.881 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -54.15 -58.99 5.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.948 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.569 ' CG ' HG13 ' A' ' 675' ' ' VAL . 23.9 mm-40 -56.44 -42.51 78.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.895 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.492 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 7.7 tp -48.49 -54.92 12.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.985 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.631 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.8 p-80 -63.67 -32.69 74.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.858 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.434 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 40.2 mttm -66.41 -23.22 66.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.901 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 22.4 pt -120.08 5.76 6.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.147 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.631 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.3 p -73.0 -25.24 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.117 179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.577 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 13.1 p90 -76.25 -52.37 10.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.863 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.577 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.0 t70 -37.14 139.84 0.48 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.577 0.703 . . . . 0.0 110.862 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.5 Cg_endo -69.8 -36.49 10.61 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.631 2.22 . . . . 0.0 112.326 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.47 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 69.3 mtm180 -63.86 -19.44 65.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.888 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.53 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 27.7 t80 -66.07 -15.14 62.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.947 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 14.1 mt -101.47 3.71 40.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.897 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.47 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 80.3 mt -83.71 -49.58 8.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.885 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.738 HD12 ' HB2' ' A' ' 666' ' ' PHE . 30.7 mt -83.81 143.91 29.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 13.6 m-80 -52.11 162.33 0.85 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.651 0.739 . . . . 0.0 110.873 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . 0.41 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.7 Cg_endo -69.79 -35.42 12.59 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.674 2.249 . . . . 0.0 112.349 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 35.5 mttm -72.16 -46.3 56.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.877 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 39.6 mm-40 -59.7 -51.2 70.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.914 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.541 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 47.3 mtm180 -40.09 -46.92 2.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.908 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 47.7 tptt -68.15 -45.89 72.29 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.884 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -58.04 -58.47 8.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.925 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 97.6 t -55.06 -37.47 42.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.121 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.682 ' O ' HG23 ' A' ' 710' ' ' VAL . 16.3 t80 -69.0 -32.13 71.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.844 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -68.58 -47.21 67.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.829 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . 0.403 ' HG2' ' N ' ' A' ' 709' ' ' TYR . 4.0 pt20 -68.17 -36.89 80.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.945 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.481 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 3.7 t80 -66.26 -41.02 90.53 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.931 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.682 HG23 ' O ' ' A' ' 706' ' ' PHE . 57.7 t -65.55 -45.51 92.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.138 179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 6.8 ttmm -57.97 -51.24 70.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.903 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.7 p -61.39 -38.16 86.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.133 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.481 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 9.4 mmp_? -65.26 -33.65 76.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.888 -179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -77.34 -49.04 15.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.15 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . 0.446 ' CG ' ' N ' ' A' ' 716' ' ' GLU . 8.5 pt-20 -58.2 -44.44 88.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.865 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . 0.446 ' N ' ' CG ' ' A' ' 715' ' ' GLU . 5.1 mm-40 -84.51 27.49 0.71 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.916 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 30.2 tp10 -104.94 96.9 6.86 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.901 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 719' ' ' ARG . 17.7 ptt180 -103.69 172.17 6.95 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.869 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . 0.435 ' C ' ' O ' ' A' ' 718' ' ' ARG . 0.1 OUTLIER -34.83 151.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.844 -179.916 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 70.5 p -170.24 173.58 5.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.872 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -116.09 -88.99 1.49 Allowed Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.494 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 138.13 36.92 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.613 2.209 . . . . 0.0 112.345 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 40.9 t -165.06 144.64 6.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.879 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 67.6 p -172.28 174.56 3.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.818 -179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.486 -180.0 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.365 0 N-CA-C 112.518 -0.233 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 83.6 p -49.59 -45.55 48.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.888 0.375 . . . . 0.0 110.845 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 41.1 t -82.02 89.31 6.41 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.862 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . -161.73 66.92 0.25 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.549 -179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 19.3 m -151.17 133.31 15.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.894 0.378 . . . . 0.0 110.859 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 4.5 m -159.14 149.74 19.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.89 -179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -151.27 105.97 0.3 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.516 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -89.44 33.55 0.82 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.804 0.335 . . . . 0.0 111.111 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 30.8 mmm-85 -124.87 154.31 41.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.884 -179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 73.4 mt-10 -125.48 110.37 13.81 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.864 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 27.9 ttt85 -132.63 141.14 48.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.854 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -119.99 51.52 1.19 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.122 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 14.9 mm -134.89 89.23 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.14 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . 0.41 ' HA ' ' HD2' ' A' ' 658' ' ' PRO . 88.8 t -61.05 111.3 3.97 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.635 0.731 . . . . 0.0 111.123 179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.514 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.5 Cg_endo -69.76 165.84 29.63 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.66 2.24 . . . . 0.0 112.317 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.412 HD12 ' HE ' ' A' ' 662' ' ' ARG . 13.8 tp -57.88 -53.43 58.33 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.905 179.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -51.84 -35.52 44.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.904 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.514 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -64.86 -68.01 0.39 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.114 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.785 ' HG3' HD21 ' A' ' 697' ' ' LEU . 14.3 ptt180 -52.12 -41.72 62.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.885 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.612 ' HA ' HD11 ' A' ' 697' ' ' LEU . 6.7 mtt -61.76 -43.27 99.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.89 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . 0.432 ' HA ' ' CE ' ' A' ' 664' ' ' LYS . 0.4 OUTLIER -58.44 -41.66 85.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.928 179.962 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . 0.568 ' OE1' HD13 ' A' ' 696' ' ' LEU . 81.5 mt-30 -61.23 -54.0 49.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.962 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.692 ' HB2' HD12 ' A' ' 697' ' ' LEU . 23.2 t80 -56.07 -45.19 79.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 6.0 ttpt -66.84 -36.47 82.42 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.919 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -60.33 -46.91 88.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.849 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.407 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 2.8 ptt? -69.2 -36.84 77.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.899 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.539 HD23 HG21 ' A' ' 675' ' ' VAL . 36.2 mt -56.4 -44.28 80.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.926 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 54.0 tp -76.34 -54.71 6.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.86 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.08 -61.9 1.95 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.892 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 21.0 mmm180 -48.07 -19.51 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.904 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 81.83 41.17 9.88 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.473 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.658 HG13 ' CG ' ' A' ' 684' ' ' GLU . 77.1 t -65.1 100.81 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.854 0.359 . . . . 0.0 111.151 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 58.2 m -52.22 148.07 6.9 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.873 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . 0.54 ' HB1' HG13 ' A' ' 710' ' ' VAL . . . -84.04 -39.34 19.73 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.126 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -82.69 43.91 0.87 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.867 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.8 m -130.86 -175.8 3.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.844 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . 0.415 HG23 ' H ' ' A' ' 683' ' ' LYS . 3.3 t -109.72 162.74 14.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.12 -179.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.495 ' CH2' ' HB3' ' A' ' 702' ' ' ARG . 35.1 t-105 -65.37 -27.31 68.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.941 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -59.44 -60.17 4.28 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.924 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.415 ' H ' HG23 ' A' ' 680' ' ' THR . 22.6 mtpt -55.23 -59.0 5.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.658 ' CG ' HG13 ' A' ' 675' ' ' VAL . 49.9 mm-40 -54.8 -41.9 71.15 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.868 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.416 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.1 tp -50.66 -55.22 17.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.841 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.1 p-80 -60.05 -35.03 74.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.844 179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.544 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 22.2 mttp -67.53 -23.04 65.4 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.899 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 6.9 pt -116.73 6.47 7.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.072 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.841 HG12 ' O ' ' A' ' 686' ' ' HIS . 9.0 p -70.93 -24.69 24.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.111 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.527 ' C ' ' CD1' ' A' ' 690' ' ' PHE . 2.4 p90 -87.98 -13.25 42.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.885 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.431 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 7.6 t70 -77.4 139.87 64.33 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.643 0.735 . . . . 0.0 110.824 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.0 Cg_endo -69.76 -34.16 15.13 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.684 2.256 . . . . 0.0 112.336 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.548 ' HA ' HD12 ' A' ' 696' ' ' LEU . 82.0 mtm180 -65.83 -16.1 63.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.858 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.432 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 33.0 t80 -70.0 -7.69 42.98 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.918 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 15.1 mt -118.13 12.14 13.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.907 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.568 HD13 ' OE1' ' A' ' 665' ' ' GLN . 90.6 mt -93.59 -23.26 18.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.886 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.785 HD21 ' HG3' ' A' ' 662' ' ' ARG . 30.8 mt -114.83 144.93 42.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.889 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 24.4 m-20 -50.06 162.05 0.52 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.635 0.731 . . . . 0.0 110.9 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 -31.1 21.07 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 122.659 2.239 . . . . 0.0 112.345 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 37.3 mtpt -72.16 -45.46 60.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.915 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.441 ' OE1' ' CE ' ' A' ' 663' ' ' MET . 18.8 mm-40 -60.12 -52.95 63.13 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.878 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.519 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 10.4 mtp180 -35.3 -48.64 0.47 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.839 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.27 -47.26 62.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.928 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -56.66 -60.77 3.07 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.905 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 94.2 t -55.31 -38.88 49.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.137 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.426 ' O ' HG23 ' A' ' 710' ' ' VAL . 43.1 t80 -62.93 -37.26 86.29 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.851 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -64.76 -58.01 7.39 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.845 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . 0.477 ' HG3' ' N ' ' A' ' 709' ' ' TYR . 10.4 pt20 -53.87 -37.02 63.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.925 -179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.477 ' N ' ' HG3' ' A' ' 708' ' ' GLN . 2.6 t80 -63.87 -43.3 96.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.886 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.54 HG13 ' HB1' ' A' ' 677' ' ' ALA . 69.6 t -67.65 -45.08 85.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.104 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 35.0 mttm -53.25 -48.96 67.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.903 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -67.99 -34.77 77.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.168 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . . . . . . . . . 7.9 mmp_? -66.79 -24.44 66.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.901 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -86.47 -46.77 9.88 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.071 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . 0.411 ' O ' ' N ' ' A' ' 717' ' ' GLU . 10.9 pt-20 -58.12 -41.93 84.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.9 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -40.53 -27.93 0.06 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.834 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . 0.411 ' N ' ' O ' ' A' ' 715' ' ' GLU . 6.8 mp0 -83.07 98.11 9.13 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.892 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 54.4 mtm180 -130.77 150.48 51.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.896 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.11 113.4 9.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.88 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 58.1 m -107.74 95.99 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.852 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -76.49 -82.75 0.51 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.515 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 154.72 67.15 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.613 2.209 . . . . 0.0 112.37 -179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 37.9 p -45.19 113.82 0.64 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.79 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 67.5 m -59.78 134.25 56.86 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.905 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.47 -179.98 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.521 -0.232 . . . . 0.0 112.521 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 29.6 m -162.85 174.21 12.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.879 -179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 56.4 m -129.71 -47.13 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.861 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 92.92 129.96 5.26 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.476 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 90.1 p -135.0 122.73 22.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.858 0.361 . . . . 0.0 110.836 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 85.8 p -154.3 164.77 38.06 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.829 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 167.43 84.41 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.478 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -50.93 106.41 0.13 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.741 0.305 . . . . 0.0 111.089 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 14.2 mtm105 -125.81 92.69 3.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.888 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 16.5 tp10 -52.8 -43.0 65.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.88 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 -80.81 155.47 26.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.856 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -117.7 55.59 0.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.097 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 61.3 mt -114.23 95.69 4.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.121 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . 0.512 HG22 ' HB3' ' A' ' 661' ' ' ALA . 12.4 p -56.17 125.21 63.69 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.624 0.726 . . . . 0.0 111.096 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.446 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.6 Cg_endo -69.75 160.8 48.35 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.733 2.289 . . . . 0.0 112.336 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.407 ' HA ' ' NE ' ' A' ' 662' ' ' ARG . 15.7 tp -56.03 -48.08 76.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.927 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -54.69 -37.01 65.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.869 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.512 ' HB3' HG22 ' A' ' 657' ' ' VAL . . . -66.54 -69.78 0.28 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.05 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.412 ' HG3' HD21 ' A' ' 697' ' ' LEU . 6.8 ptt180 -49.35 -45.39 45.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.91 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.5 mtt -60.87 -45.09 95.92 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.894 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 1.3 mmmm -55.05 -44.03 74.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -60.48 -62.08 2.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.939 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.716 ' HB2' HD12 ' A' ' 697' ' ' LEU . 20.9 t80 -49.12 -53.02 22.63 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 -179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 35.0 tttt -54.6 -45.6 73.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.92 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -51.71 -44.52 63.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.89 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.4 ' O ' ' C ' ' A' ' 670' ' ' LEU . 8.4 mtm -62.3 -63.35 1.26 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.906 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' A' ' 669' ' ' MET . 49.2 mt -38.49 -40.69 0.59 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 54.8 tp -75.9 -56.12 4.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.909 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . 0.475 ' O ' ' N ' ' A' ' 674' ' ' GLY . 8.2 mm-40 -59.23 -65.74 0.62 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.86 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . 0.41 ' HA ' ' NE ' ' A' ' 673' ' ' ARG . 14.1 mmp_? -39.22 -26.82 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.854 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . 0.475 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 86.44 34.61 11.71 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.503 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.738 HG13 ' HG3' ' A' ' 684' ' ' GLU . 76.7 t -60.29 99.07 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.868 0.366 . . . . 0.0 111.087 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 4.1 m -49.47 151.11 1.66 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.895 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -83.68 -26.69 29.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.103 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -102.01 48.12 0.88 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.9 m -123.97 -175.0 3.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.889 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 40.0 p -107.85 148.43 29.57 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.1 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 31.2 t-105 -59.56 -29.13 67.71 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.899 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -63.73 -53.69 47.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.831 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.519 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 10.8 mtpp -58.79 -59.06 6.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.738 ' HG3' HG13 ' A' ' 675' ' ' VAL . 64.6 mm-40 -55.32 -37.02 66.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 4.9 tp -54.53 -63.18 1.23 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.796 ' O ' HG12 ' A' ' 689' ' ' VAL . 5.6 p-80 -56.86 -29.26 62.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.809 179.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . . . . . . . . . 41.2 mttt -68.13 -32.08 72.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.932 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 11.2 pt -112.78 9.94 8.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.108 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.796 HG12 ' O ' ' A' ' 686' ' ' HIS . 7.9 p -70.02 -24.66 26.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.131 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.574 ' CD1' ' N ' ' A' ' 691' ' ' ASP . 10.4 p90 -80.08 -51.9 8.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.869 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.574 ' N ' ' CD1' ' A' ' 690' ' ' PHE . 7.6 t70 -34.0 140.09 0.26 Allowed Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.591 0.71 . . . . 0.0 110.904 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.67 -38.33 8.15 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.699 2.266 . . . . 0.0 112.357 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.468 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 28.7 mtm180 -65.56 -25.04 67.25 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.87 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.407 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 19.4 t80 -58.24 -11.59 2.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.897 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 30.9 mt -114.14 25.59 10.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.938 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.468 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 95.9 mt -109.52 -28.46 8.89 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.716 HD12 ' HB2' ' A' ' 666' ' ' PHE . 32.1 mt -103.21 139.37 38.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.971 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -48.5 162.62 0.35 Allowed Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.598 0.713 . . . . 0.0 110.946 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 -35.43 12.72 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.672 2.248 . . . . 0.0 112.348 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 18.2 tptm -72.15 -42.47 65.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.918 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.408 ' O ' ' C ' ' A' ' 702' ' ' ARG . 26.4 mt-10 -60.0 -51.47 69.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.587 ' HG2' ' CE1' ' A' ' 666' ' ' PHE . 40.5 mtp180 -37.93 -51.04 1.33 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.871 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 19.3 tptm -66.09 -46.83 76.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.877 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 4.3 mm100 -56.28 -61.06 2.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.882 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 84.6 t -56.19 -41.54 70.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.097 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.466 ' O ' HG23 ' A' ' 710' ' ' VAL . 21.9 t80 -60.32 -44.08 95.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.908 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -58.12 -48.07 81.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.853 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -61.11 -45.18 95.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.917 -179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.523 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 5.5 t80 -55.92 -44.95 78.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.925 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 706' ' ' PHE . 90.3 t -62.87 -51.91 65.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.134 179.88 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -45.98 -48.38 16.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.899 179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.2 p -65.28 -46.54 80.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.145 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.523 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 12.5 mmp_? -59.22 -21.06 58.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.904 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -86.42 -59.97 2.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.045 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -46.23 -35.19 4.97 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.851 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . 0.438 ' O ' ' N ' ' A' ' 718' ' ' ARG . 5.5 mm-40 -87.89 30.49 0.84 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.879 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -53.47 88.38 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.903 -179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . 0.438 ' N ' ' O ' ' A' ' 716' ' ' GLU . 12.7 mmm-85 -98.54 161.69 13.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.857 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -114.53 -48.9 2.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.876 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 39.8 t -116.64 148.64 40.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.866 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 107.34 146.23 12.73 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.488 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 144.53 54.1 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.671 2.247 . . . . 0.0 112.349 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 2.8 t -102.33 -44.76 5.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.905 -179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 88.0 p -82.12 81.29 8.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.838 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.519 179.997 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 7.3 m -65.53 152.44 44.02 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.92 0.39 . . . . 0.0 110.837 -179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 57.9 m -103.02 86.48 2.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.873 -179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 70.68 -144.64 38.88 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.482 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 58.4 m 38.65 50.05 1.54 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.889 0.376 . . . . 0.0 110.861 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 8.2 t -120.3 104.64 10.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.834 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 98.7 67.95 0.9 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.482 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -96.43 103.59 15.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.779 0.323 . . . . 0.0 111.09 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -135.77 111.85 9.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.864 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -85.21 41.69 0.9 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.875 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . 0.502 ' HG3' HD13 ' A' ' 656' ' ' ILE . 38.3 ttm180 -73.19 91.82 1.69 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.891 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -85.97 37.19 0.7 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.107 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . 0.502 HD13 ' HG3' ' A' ' 654' ' ' ARG . 5.3 mp -111.83 102.93 14.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.134 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 92.4 t -95.02 123.41 57.47 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.598 0.714 . . . . 0.0 111.178 179.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.504 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.1 Cg_endo -69.81 159.98 51.38 Favored 'Trans proline' 0 C--O 1.232 0.205 0 C-N-CA 122.708 2.272 . . . . 0.0 112.331 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 17.5 tp -57.81 -46.8 84.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.909 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -55.81 -32.17 63.31 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.92 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.504 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -70.84 -66.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.122 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.576 ' HG3' HD21 ' A' ' 697' ' ' LEU . 5.8 ptm180 -51.91 -48.84 63.98 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.913 -179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 9.1 mtt -57.52 -48.52 79.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.935 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 13.9 mmmt -51.22 -44.71 61.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -59.24 -60.53 3.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.931 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.462 ' CE2' HD11 ' A' ' 670' ' ' LEU . 27.9 t80 -47.72 -59.9 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.88 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 25.3 ttmt -46.24 -50.93 15.31 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.887 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -48.91 -48.14 42.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.84 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . . . . . . . . . 3.8 mtm -56.37 -62.37 1.76 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.907 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.462 HD11 ' CE2' ' A' ' 666' ' ' PHE . 49.4 mt -41.23 -38.72 1.18 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.909 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 20.8 tp -72.52 -47.33 49.26 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.921 179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . 0.425 ' O ' ' C ' ' A' ' 673' ' ' ARG . 12.3 mm-40 -71.69 -66.02 0.69 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.872 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 672' ' ' GLU . 13.2 mmt-85 -36.26 -39.26 0.17 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.875 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 100.01 29.61 6.75 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.531 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.621 HG12 ' O ' ' A' ' 675' ' ' VAL . 19.4 t -59.57 87.54 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.877 0.37 . . . . 0.0 111.126 -179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 675' ' ' VAL . 50.8 m -37.15 155.09 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.861 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -100.11 -4.82 28.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.06 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -117.03 36.3 4.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.889 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 2.1 m -125.13 -177.02 3.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.841 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 2.8 p -94.14 153.52 18.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.156 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.558 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 29.1 t-105 -63.09 -30.56 71.69 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.879 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.33 -57.17 13.9 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.86 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 9.2 mttp -56.2 -59.09 5.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.898 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.509 ' OE1' ' CZ ' ' A' ' 706' ' ' PHE . 8.1 mt-10 -55.4 -43.75 75.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.918 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.558 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 6.4 tp -47.35 -61.75 1.76 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.57 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.8 p-80 -56.32 -35.36 67.47 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.859 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.515 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 13.4 mtmt -63.67 -25.47 68.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.867 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 13.7 pt -121.07 11.84 6.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.143 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.57 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.3 p -80.29 -34.68 14.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.11 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.448 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 4.8 p90 -67.15 -43.28 82.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.906 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.448 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.5 t70 -46.58 139.72 6.11 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.563 0.696 . . . . 0.0 110.848 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 54.1 Cg_endo -69.74 -42.0 3.81 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.705 2.27 . . . . 0.0 112.318 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 19.6 mtm-85 -56.71 -23.57 43.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.576 ' CE2' ' HD3' ' A' ' 702' ' ' ARG . 0.8 OUTLIER -65.72 -30.12 70.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.911 -179.859 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.427 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 35.7 mt -78.73 -6.46 55.9 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.889 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 84.5 mt -74.88 -52.74 10.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.916 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.576 HD21 ' HG3' ' A' ' 662' ' ' ARG . 11.7 mt -78.21 156.62 29.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.926 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -68.64 164.05 48.92 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.645 0.736 . . . . 0.0 110.857 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 -35.41 12.73 Favored 'Trans proline' 0 N--CA 1.465 -0.176 0 C-N-CA 122.717 2.278 . . . . 0.0 112.38 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -72.44 -45.65 58.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.892 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.478 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -60.44 -53.47 57.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.899 179.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.576 ' HD3' ' CE2' ' A' ' 694' ' ' TYR . 68.7 mtt180 -34.49 -46.65 0.28 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.899 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 4.4 tmtm? -72.15 -46.23 57.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.841 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -56.26 -55.93 27.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.918 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.75 -48.41 81.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.158 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.689 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 19.2 t80 -55.43 -45.48 76.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.906 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -55.66 -47.7 76.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.845 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -64.53 -40.86 96.4 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.908 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.532 ' CZ ' ' HG3' ' A' ' 713' ' ' ARG . 11.7 t80 -63.95 -46.13 86.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.889 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.689 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 68.9 t -63.71 -48.92 84.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.092 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 64.2 mttt -51.89 -45.52 64.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.889 179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -71.66 -41.07 69.19 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.147 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.532 ' HG3' ' CZ ' ' A' ' 709' ' ' TYR . 4.7 mmp_? -59.23 -33.32 70.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.908 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -81.63 -55.01 4.93 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.095 179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -56.07 -19.15 11.82 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.894 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . 0.424 ' O ' ' N ' ' A' ' 718' ' ' ARG . 8.0 tt0 -103.01 28.85 5.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.926 -179.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -60.81 80.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.897 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . 0.424 ' N ' ' O ' ' A' ' 716' ' ' GLU . 4.0 ptt85 -91.3 138.58 31.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.868 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -94.27 142.27 27.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.855 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 40.2 t -79.25 156.04 28.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.859 -179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -133.42 -86.49 0.28 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.465 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -42.66 3.27 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.684 2.256 . . . . 0.0 112.331 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 97.5 p -76.02 156.88 33.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.852 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 44.6 m -126.68 135.26 50.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.847 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.514 -179.974 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.466 -0.254 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 19.4 t -89.68 135.92 33.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.852 0.358 . . . . 0.0 110.843 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 25.1 p -105.68 118.07 35.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.856 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . -154.12 158.34 28.08 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.488 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 3.4 m -158.78 139.58 12.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.833 0.349 . . . . 0.0 110.89 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 2.3 m -78.66 105.76 10.18 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.858 -179.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 108.49 122.16 4.65 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.45 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -109.22 115.58 30.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.736 0.303 . . . . 0.0 111.116 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 17.6 ptp180 -44.51 -42.06 6.89 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.86 -179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . 0.674 ' HB2' HD12 ' A' ' 656' ' ' ILE . 7.5 mm-40 -131.65 175.08 9.48 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.854 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 24.5 mmm180 -106.99 -19.13 13.72 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.875 -179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -96.67 36.18 1.42 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.105 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . 0.674 HD12 ' HB2' ' A' ' 653' ' ' GLU . 95.1 mt -130.03 113.16 25.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.124 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 10.6 p -120.41 126.53 26.73 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.596 0.713 . . . . 0.0 111.13 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.53 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.9 Cg_endo -69.71 159.03 54.95 Favored 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.691 2.261 . . . . 0.0 112.335 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 43.0 tp -59.42 -49.43 77.85 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -52.97 -36.58 60.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.925 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.53 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -68.69 -69.49 0.32 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.119 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.711 ' HG3' HD21 ' A' ' 697' ' ' LEU . 4.3 ptm180 -47.72 -53.27 15.61 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.904 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.919 ' HA ' HD11 ' A' ' 697' ' ' LEU . 11.4 mtt -53.24 -44.4 68.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.933 179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.29 -31.87 70.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.891 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 7.9 mm-40 -67.45 -59.32 3.48 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.83 ' HB2' HD12 ' A' ' 697' ' ' LEU . 26.5 t80 -55.03 -55.82 26.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.889 -179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . 0.518 ' HA ' HD12 ' A' ' 670' ' ' LEU . 0.2 OUTLIER -54.8 -44.31 73.68 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.865 -179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -52.15 -52.75 49.83 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.859 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.489 ' HE2' ' CD1' ' A' ' 666' ' ' PHE . 3.0 ptt? -67.73 -39.09 84.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.908 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 667' ' ' LYS . 24.9 mt -47.52 -46.98 28.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.925 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 14.7 tp -79.62 -48.2 14.16 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.878 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . 0.433 ' O ' ' N ' ' A' ' 674' ' ' GLY . 27.9 mm-40 -55.6 -66.02 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.897 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 9.1 mmp_? -42.76 -23.37 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.872 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' A' ' 672' ' ' GLU . . . 87.33 43.99 5.72 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.485 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.458 HG13 ' CG ' ' A' ' 684' ' ' GLU . 87.9 t -71.25 101.42 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.861 0.363 . . . . 0.0 111.18 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 3.2 t -61.35 154.93 22.64 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.891 -179.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . 0.557 ' HA ' HG13 ' A' ' 710' ' ' VAL . . . -87.3 -47.88 8.46 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.089 179.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -58.56 -27.06 64.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.879 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 39.2 m -65.96 167.55 9.54 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.897 -179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 30.3 p -92.29 163.34 13.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.14 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . . . . . . . . . 4.4 t-105 -67.31 -31.5 71.84 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.923 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -58.83 -56.9 16.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.846 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -56.52 -59.03 5.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.934 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.458 ' CG ' HG13 ' A' ' 675' ' ' VAL . 63.1 mm-40 -53.94 -40.68 67.0 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.889 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . . . . . . . . . 5.7 tp -52.09 -59.12 4.73 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.932 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.7 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.6 p-80 -56.49 -33.31 65.84 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.83 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.521 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 48.0 mttt -65.56 -31.7 72.89 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.872 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 12.5 pt -112.83 11.07 8.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.11 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.7 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.3 p -76.69 -32.9 21.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.171 179.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 13.7 p90 -74.99 -28.66 60.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.879 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.431 ' CG ' ' HD2' ' A' ' 692' ' ' PRO . 11.6 t70 -63.4 139.81 97.63 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.585 0.707 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.431 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.2 Cg_endo -69.77 -40.63 5.08 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.703 2.269 . . . . 0.0 112.324 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . . . . . . . . . 36.7 mtm180 -57.99 -22.14 48.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.834 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.637 ' CE1' ' NH1' ' A' ' 702' ' ' ARG . 11.6 t80 -67.13 -3.56 7.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.94 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 28.2 mt -111.49 -13.95 13.78 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.904 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.56 -46.05 90.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.928 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.919 HD11 ' HA ' ' A' ' 663' ' ' MET . 30.1 mt -93.68 140.54 29.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.88 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -48.87 162.81 0.36 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.599 0.714 . . . . 0.0 110.924 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . 0.462 ' N ' HH21 ' A' ' 702' ' ' ARG . 53.6 Cg_endo -69.76 -32.18 19.07 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.738 2.292 . . . . 0.0 112.338 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -72.23 -46.92 54.03 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.861 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -61.0 -49.84 75.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.879 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.637 ' NH1' ' CE1' ' A' ' 694' ' ' TYR . 56.8 mtm180 -42.66 -43.5 3.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.87 -179.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -71.2 -42.86 68.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.903 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -60.4 -57.31 13.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.923 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 74.5 t -56.91 -43.69 80.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.118 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.677 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 20.9 t80 -61.74 -43.39 98.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.891 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -55.59 -49.0 73.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.857 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -63.47 -38.05 89.64 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.932 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.593 ' C ' ' CD1' ' A' ' 709' ' ' TYR . 0.3 OUTLIER -66.69 -38.15 86.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.927 -179.859 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.677 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 99.4 t -72.98 -53.7 17.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.137 179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -49.42 -51.61 34.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.888 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 10.6 p -66.25 -36.56 83.33 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.15 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.565 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 9.9 mmm180 -66.02 -34.35 77.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.884 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -75.67 -52.19 11.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.082 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . 0.413 ' CG ' ' N ' ' A' ' 716' ' ' GLU . 9.1 pt-20 -54.33 -42.5 70.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.872 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . 0.443 ' O ' ' C ' ' A' ' 717' ' ' GLU . 13.0 mt-10 -84.16 23.87 1.01 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.882 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 716' ' ' GLU . 11.7 pt-20 -34.32 128.96 0.4 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 -179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 18.0 mtp85 -117.73 115.9 25.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.85 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -71.97 102.51 2.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.873 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 4.2 t 66.83 41.15 2.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.819 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -71.59 -159.09 3.6 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.482 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.77 161.19 46.9 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.657 2.238 . . . . 0.0 112.381 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 50.3 p -112.29 -44.0 3.45 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.839 -179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 37.1 p -99.17 152.71 19.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.807 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.491 179.99 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 N-CA-C 112.446 -0.261 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 37.0 t -110.76 104.17 12.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.875 0.369 . . . . 0.0 110.896 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 50.6 p -80.19 149.7 30.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.915 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . -142.55 63.71 0.5 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.471 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 36.4 p -103.49 116.77 33.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.844 0.354 . . . . 0.0 110.852 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 46.6 t -73.66 143.67 46.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.864 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . -67.43 -136.64 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.505 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -137.11 165.53 25.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.815 0.341 . . . . 0.0 111.103 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 88.2 mtt-85 -118.63 -55.15 2.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.881 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -118.68 151.44 37.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.871 -179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -112.32 130.33 55.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.85 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -116.0 178.76 4.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.081 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 51.8 mt -90.71 93.85 4.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.15 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . 0.607 ' HB ' ' HB3' ' A' ' 661' ' ' ALA . 2.9 m -61.42 151.78 75.87 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.632 0.73 . . . . 0.0 111.146 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.61 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 54.1 Cg_endo -69.76 149.19 66.59 Favored 'Trans proline' 0 C--O 1.232 0.196 0 C-N-CA 122.721 2.281 . . . . 0.0 112.345 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 21.4 tp -44.25 -36.56 2.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.933 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -71.24 -31.72 67.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.882 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.61 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -66.25 -55.79 14.42 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.121 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.505 ' HD2' HG23 ' A' ' 657' ' ' VAL . 0.0 OUTLIER -60.22 -54.87 40.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.869 -179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.833 ' HA ' HD11 ' A' ' 697' ' ' LEU . 16.1 mtt -51.05 -47.6 61.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.887 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.54 -45.43 73.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.921 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -59.69 -50.63 73.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.898 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.553 ' CE2' HD11 ' A' ' 670' ' ' LEU . 30.9 t80 -57.74 -58.98 5.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.896 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 2.3 ttmp? -51.14 -37.69 47.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.891 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -58.24 -52.52 65.22 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.852 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 693' ' ' ARG . 2.8 ptt? -67.31 -35.82 80.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.909 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.553 HD11 ' CE2' ' A' ' 666' ' ' PHE . 20.0 mt -52.45 -52.56 53.47 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.93 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . 0.407 HD13 ' HE ' ' A' ' 713' ' ' ARG . 13.2 tp -78.09 -43.16 29.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -55.31 -65.63 0.55 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.903 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 10.2 mmp_? -45.86 -26.14 0.63 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.89 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 92.12 38.36 5.72 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.518 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.608 HG13 ' CG ' ' A' ' 684' ' ' GLU . 42.0 t -61.06 112.47 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.843 0.354 . . . . 0.0 111.17 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 16.1 m -70.22 127.51 33.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.878 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -67.97 -53.35 26.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.124 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . 0.455 ' CZ ' ' OE2' ' A' ' 717' ' ' GLU . 74.3 m-85 -51.59 -32.32 28.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.934 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 3.3 m -62.08 -178.69 0.17 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.804 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 16.9 p -102.5 167.31 10.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.104 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.464 ' O ' ' CB ' ' A' ' 685' ' ' LEU . 32.6 t-105 -66.9 -24.75 66.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.913 179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -64.0 -63.12 1.24 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.916 -179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.01 -58.97 4.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.608 ' CG ' HG13 ' A' ' 675' ' ' VAL . 50.0 mm-40 -56.67 -44.63 81.6 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.866 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.464 ' CB ' ' O ' ' A' ' 681' ' ' TRP . 6.4 tp -48.22 -50.49 29.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.982 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.764 ' O ' HG12 ' A' ' 689' ' ' VAL . 1.2 p-80 -65.9 -33.87 76.82 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.88 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.577 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 51.7 mttt -65.94 -23.6 66.64 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.832 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 7.2 pt -117.8 3.17 7.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.182 179.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.764 HG12 ' O ' ' A' ' 686' ' ' HIS . 7.9 p -68.2 -33.13 58.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.099 179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . . . . . . . . . 40.5 p90 -84.26 5.29 27.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.876 -179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.488 ' OD1' ' N ' ' A' ' 693' ' ' ARG . 4.7 t70 -92.72 142.63 25.91 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.625 0.726 . . . . 0.0 110.862 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.418 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.9 Cg_endo -69.72 -47.84 0.86 Allowed 'Trans proline' 0 N--CA 1.465 -0.197 0 C-N-CA 122.705 2.27 . . . . 0.0 112.385 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.493 ' HA ' HD12 ' A' ' 696' ' ' LEU . 79.1 mtm180 -53.07 -25.29 12.25 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.469 ' O ' ' CG ' ' A' ' 694' ' ' TYR . 19.6 t80 -65.66 -5.23 7.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.923 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 30.8 mt -118.05 10.95 13.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.905 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' A' ' 693' ' ' ARG . 94.1 mt -94.12 -31.79 14.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.943 179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.833 HD11 ' HA ' ' A' ' 663' ' ' MET . 40.1 mt -102.56 141.09 35.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.969 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 -47.5 162.36 0.3 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.667 0.746 . . . . 0.0 110.853 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . 0.42 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.0 Cg_endo -69.72 -34.16 15.27 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.651 2.234 . . . . 0.0 112.374 179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 17.8 mmtp -72.27 -44.56 62.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.908 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.461 ' CD ' ' N ' ' A' ' 701' ' ' GLU . 0.0 OUTLIER -62.02 -49.64 75.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.901 179.934 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.432 ' NH1' ' O ' ' A' ' 694' ' ' TYR . 43.3 mtm180 -42.7 -44.69 4.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.903 -179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 7.7 tppt? -69.3 -46.33 67.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.913 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -57.03 -55.07 39.45 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.881 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 86.6 t -58.68 -37.47 65.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.105 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.567 ' O ' HG23 ' A' ' 710' ' ' VAL . 75.0 t80 -67.27 -34.6 77.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.875 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -64.7 -54.22 34.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.883 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . 0.461 ' CG ' ' N ' ' A' ' 709' ' ' TYR . 7.6 pt20 -57.84 -45.38 86.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.941 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.693 ' CD2' ' CZ ' ' A' ' 713' ' ' ARG . 2.7 t80 -56.99 -52.71 64.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.922 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 706' ' ' PHE . 92.3 t -59.66 -39.23 79.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.168 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 61.5 tttt -53.54 -51.25 63.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.967 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . 0.436 ' O ' ' N ' ' A' ' 714' ' ' ALA . 20.3 p -70.03 -67.12 0.51 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.156 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.693 ' CZ ' ' CD2' ' A' ' 709' ' ' TYR . 10.4 mpt_? -42.34 -23.7 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.869 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . 0.436 ' N ' ' O ' ' A' ' 712' ' ' THR . . . -90.22 -54.52 3.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.1 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.39 -30.02 62.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.87 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -87.35 22.12 2.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 -179.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . 0.455 ' OE2' ' CZ ' ' A' ' 678' ' ' PHE . 4.7 tp10 -45.58 116.59 1.21 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.869 -179.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . 0.452 ' C ' ' O ' ' A' ' 717' ' ' GLU . 11.7 ttt180 -34.29 122.69 0.5 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.895 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 22.8 ttp180 -77.96 153.71 32.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.866 -179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 3.2 t -75.98 -59.09 2.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.853 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -48.32 157.66 0.93 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.445 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 127.71 14.98 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.647 2.231 . . . . 0.0 112.355 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 2.5 t -95.81 -47.42 6.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.863 -179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 54.7 p -107.48 160.09 15.92 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.891 -179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.3 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.454 179.988 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.467 -0.253 . . . . 0.0 112.467 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 2.2 m -81.4 170.92 15.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.876 0.369 . . . . 0.0 110.858 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 74.4 m -103.29 -43.65 5.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.867 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 103.86 -173.52 21.77 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.505 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 80.5 p -164.22 174.05 11.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.925 0.393 . . . . 0.0 110.868 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 46.9 p -138.92 122.94 17.88 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.826 -179.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 60.11 58.74 12.51 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.465 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . . . . . . . . . . . -104.77 126.77 52.18 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.807 0.337 . . . . 0.0 111.081 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.92 150.07 49.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.9 -179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -110.88 39.33 2.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.902 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 51.8 mtm180 -71.3 -52.53 18.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.856 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -42.79 156.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.088 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . . . . . . . . . 5.0 mp -96.92 94.61 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.128 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 82.5 t -52.01 127.84 37.15 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 121.629 0.728 . . . . 0.0 111.137 179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 661' ' ' ALA . 53.5 Cg_endo -69.75 158.18 57.85 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.712 2.274 . . . . 0.0 112.3 179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 25.6 tp -56.07 -47.29 78.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.894 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . 0.441 ' HG3' ' N ' ' A' ' 661' ' ' ALA . 8.1 pt-20 -56.35 -36.0 68.28 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.864 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . 0.536 ' HB2' ' HG2' ' A' ' 658' ' ' PRO . . . -68.39 -71.04 0.23 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.105 179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -46.92 -48.96 21.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.839 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.436 ' HA ' HD11 ' A' ' 697' ' ' LEU . 5.4 mtt -55.25 -49.09 72.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.859 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.71 -48.23 50.02 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.939 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' A' ' 669' ' ' MET . 72.5 mt-30 -56.7 -61.21 2.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.901 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.557 ' CE1' ' HG2' ' A' ' 702' ' ' ARG . 21.2 t80 -43.53 -60.62 1.67 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.874 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -51.04 -47.71 61.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.902 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -50.18 -41.15 48.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.915 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.403 ' HG3' ' O ' ' A' ' 665' ' ' GLN . 4.4 mtm -65.4 -63.42 1.1 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.864 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . . . . . . . . . 57.3 mt -39.38 -40.11 0.76 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.919 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 19.8 tp -76.64 -45.9 28.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.928 179.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -65.22 -62.77 1.34 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.913 179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -46.23 -21.81 0.19 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.898 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 84.29 42.68 7.36 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.506 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.66 HG13 ' CG ' ' A' ' 684' ' ' GLU . 37.3 t -70.01 100.61 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.837 0.351 . . . . 0.0 111.115 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 20.3 m -56.2 141.22 41.8 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.843 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -77.85 -37.87 47.35 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.07 179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 46.1 m-85 -81.47 44.92 0.83 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.902 -179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.7 m -133.67 -177.2 4.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.896 -179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . 0.626 HG23 ' H ' ' A' ' 683' ' ' LYS . 5.2 t -99.1 154.14 18.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.154 -179.915 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.558 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 3.3 t-105 -65.47 -32.63 74.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -57.97 -48.89 78.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.918 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.626 ' H ' HG23 ' A' ' 680' ' ' THR . 32.4 mttm -62.85 -59.02 5.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.909 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.66 ' CG ' HG13 ' A' ' 675' ' ' VAL . 56.0 mm-40 -55.76 -37.3 68.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.886 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.558 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 8.0 tp -56.58 -62.94 1.38 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.919 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.756 ' O ' HG12 ' A' ' 689' ' ' VAL . 2.1 p-80 -51.72 -36.01 45.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.873 179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.582 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 37.5 mttm -64.26 -33.47 75.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.918 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 23.9 pt -108.09 10.06 9.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.092 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.756 HG12 ' O ' ' A' ' 686' ' ' HIS . 3.3 p -78.17 -11.71 13.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.115 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.424 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 11.4 p90 -90.49 -41.61 11.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.879 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.424 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 10.6 t70 -53.59 139.8 48.77 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.595 0.712 . . . . 0.0 110.875 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.8 Cg_endo -69.76 -42.49 3.35 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.659 2.239 . . . . 0.0 112.372 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.459 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 22.4 mtm-85 -53.41 -20.66 4.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.897 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.576 ' CE2' ' NH1' ' A' ' 702' ' ' ARG . 40.3 t80 -63.3 -25.56 68.37 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.884 -179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 28.6 mt -85.73 -20.26 29.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.944 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.459 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 78.8 mt -59.27 -47.65 84.56 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.967 179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 663' ' ' MET . 10.8 mt -85.18 145.1 27.77 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.884 179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -60.55 164.16 7.65 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.646 0.736 . . . . 0.0 110.861 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . 0.415 ' N ' HH21 ' A' ' 702' ' ' ARG . 54.2 Cg_endo -69.67 -34.05 15.66 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.642 2.228 . . . . 0.0 112.394 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 15.2 mmtp -72.38 -47.03 52.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.904 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.414 ' O ' ' C ' ' A' ' 702' ' ' ARG . 6.0 mm-40 -61.46 -54.17 46.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.821 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.576 ' NH1' ' CE2' ' A' ' 694' ' ' TYR . 30.6 mtm180 -37.1 -45.04 0.58 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.924 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 3.2 tppt? -70.27 -45.8 65.67 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.924 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -60.84 -58.98 6.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.887 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 44.1 t -50.68 -52.54 16.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.146 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.412 ' CZ ' HG21 ' A' ' 710' ' ' VAL . 20.2 t80 -51.1 -55.14 19.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.858 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -45.49 -51.18 12.05 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.893 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -60.63 -44.42 96.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.939 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.467 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 1.5 t80 -56.97 -42.63 80.52 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.951 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.412 HG21 ' CZ ' ' A' ' 706' ' ' PHE . 85.0 t -66.3 -39.3 83.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.137 179.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 46.9 tttt -58.82 -41.34 86.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.87 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 4.8 p -73.74 -41.68 62.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.133 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.477 ' HA ' ' CZ ' ' A' ' 713' ' ' ARG . 0.1 OUTLIER -66.3 -27.0 67.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.861 -179.955 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -83.69 -52.77 6.15 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.102 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -53.19 -41.91 65.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.902 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -46.71 -21.5 0.2 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.869 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.6 110.04 3.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.884 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -40.63 140.19 0.71 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.848 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 19.7 tpt180 -97.38 129.79 44.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.843 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 80.1 p -91.68 151.99 20.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.86 -179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . -117.72 146.23 18.63 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.517 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -12.14 32.26 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.689 2.259 . . . . 0.0 112.336 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 15.9 m -72.93 113.92 10.5 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.864 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 32.8 t -41.76 161.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.865 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.274 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.482 -179.964 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 644' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.289 0 N-CA-C 112.512 -0.235 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 645' ' ' SER . . . . . . . . . . . . . 23.2 t -115.71 134.88 54.59 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.872 0.368 . . . . 0.0 110.848 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 646' ' ' SER . . . . . . . . . . . . . 20.1 t -169.28 113.78 0.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.855 -179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 166.14 122.76 0.62 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.492 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 648' ' ' SER . . . . . . . . . . . . . 69.3 m -151.18 147.87 27.56 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.902 0.382 . . . . 0.0 110.853 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 649' ' ' SER . . . . . . . . . . . . . 78.3 p -121.73 160.66 24.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.88 -179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 650' ' ' GLY . . . . . . . . . . . . . . . 38.76 88.68 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.5 -179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 651' ' ' ALA . . . . . 0.645 ' HB1' ' OE2' ' A' ' 653' ' ' GLU . . . -117.48 98.63 6.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.799 0.333 . . . . 0.0 111.095 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 652' ' ' ARG . . . . . . . . . . . . . 10.2 mmt85 -122.31 47.92 1.83 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.861 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 653' ' ' GLU . . . . . 0.645 ' OE2' ' HB1' ' A' ' 651' ' ' ALA . 2.0 pm0 -92.82 72.36 4.86 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 654' ' ' ARG . . . . . . . . . . . . . 30.0 ttt180 -67.95 -61.24 1.96 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.872 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 655' ' ' ALA . . . . . . . . . . . . . . . -106.38 46.08 0.94 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.151 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 656' ' ' ILE . . . . . 0.719 HG22 ' HD3' ' A' ' 658' ' ' PRO . 94.0 mt -138.8 109.88 5.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.08 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 657' ' ' VAL . . . . . . . . . . . . . 75.6 t -121.11 81.89 36.71 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.642 0.734 . . . . 0.0 111.133 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 658' ' ' PRO . . . . . 0.719 ' HD3' HG22 ' A' ' 656' ' ' ILE . 54.0 Cg_endo -69.73 161.72 44.85 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.746 2.297 . . . . 0.0 112.33 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 36.2 tp -53.48 -47.35 69.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.912 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 660' ' ' GLU . . . . . 0.439 ' O ' ' CG ' ' A' ' 664' ' ' LYS . 1.5 mp0 -56.53 -34.2 66.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.874 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 661' ' ' ALA . . . . . . . . . . . . . . . -67.97 -67.93 0.43 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.046 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 662' ' ' ARG . . . . . 0.471 ' HE ' HD23 ' A' ' 697' ' ' LEU . 6.4 ptm180 -48.62 -55.69 10.53 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.921 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 5.9 mtt -54.15 -47.18 72.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.867 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 664' ' ' LYS . . . . . 0.439 ' CG ' ' O ' ' A' ' 660' ' ' GLU . 11.7 mmmt -51.18 -48.88 61.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.869 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 665' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -56.44 -60.72 3.12 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.933 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 666' ' ' PHE . . . . . 0.477 ' CE2' HD11 ' A' ' 670' ' ' LEU . 19.3 t80 -46.41 -62.01 1.55 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 667' ' ' LYS . . . . . . . . . . . . . 57.5 tttt -47.55 -49.18 27.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.914 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 668' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -47.62 -49.63 26.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.867 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 669' ' ' MET . . . . . 0.454 ' O ' ' N ' ' A' ' 672' ' ' GLU . 4.6 mtm -59.07 -64.51 0.92 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.849 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 670' ' ' LEU . . . . . 0.477 HD11 ' CE2' ' A' ' 666' ' ' PHE . 50.4 mt -37.54 -41.7 0.48 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.916 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 671' ' ' LEU . . . . . . . . . . . . . 23.4 tp -76.8 -38.76 53.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.909 179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 672' ' ' GLU . . . . . 0.454 ' N ' ' O ' ' A' ' 669' ' ' MET . 5.7 mm-40 -73.29 -65.98 0.74 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.888 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 673' ' ' ARG . . . . . 0.434 ' NE ' ' HA ' ' A' ' 673' ' ' ARG . 5.4 mmp_? -39.63 -33.91 0.21 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.837 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 674' ' ' GLY . . . . . . . . . . . . . . . 97.89 25.09 10.87 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.48 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 675' ' ' VAL . . . . . 0.624 HG13 ' CD ' ' A' ' 684' ' ' GLU . 39.8 t -51.82 97.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.84 0.353 . . . . 0.0 111.103 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 676' ' ' SER . . . . . . . . . . . . . 43.4 m -54.75 132.14 45.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.853 -179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 677' ' ' ALA . . . . . . . . . . . . . . . -64.95 -47.55 77.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.098 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 678' ' ' PHE . . . . . . . . . . . . . 26.2 m-85 -76.85 48.02 0.55 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.867 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 679' ' ' SER . . . . . . . . . . . . . 1.3 t -130.84 176.61 8.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.901 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 680' ' ' THR . . . . . . . . . . . . . 61.1 p -94.51 142.1 27.83 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.107 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 681' ' ' TRP . . . . . 0.521 ' CZ2' HD13 ' A' ' 685' ' ' LEU . 34.9 t-105 -57.12 -31.65 65.53 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.964 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 682' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -60.32 -56.01 26.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.881 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 683' ' ' LYS . . . . . 0.552 ' HA ' ' CE1' ' A' ' 686' ' ' HIS . 44.6 mttt -57.99 -59.01 5.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.908 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 684' ' ' GLU . . . . . 0.624 ' CD ' HG13 ' A' ' 675' ' ' VAL . 21.6 mm-40 -56.04 -41.04 74.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.898 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 685' ' ' LEU . . . . . 0.521 HD13 ' CZ2' ' A' ' 681' ' ' TRP . 9.4 tp -50.63 -58.88 4.79 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.935 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 686' ' ' HIS . . . . . 0.588 ' O ' HG12 ' A' ' 689' ' ' VAL . 3.8 p-80 -60.62 -29.96 69.55 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.86 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 687' ' ' LYS . . . . . 0.418 ' N ' ' CD2' ' A' ' 686' ' ' HIS . 66.4 mttt -67.03 -27.59 67.53 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.943 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 13.1 pt -117.97 8.3 6.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.104 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.588 HG12 ' O ' ' A' ' 686' ' ' HIS . 4.0 p -74.84 -28.36 21.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.157 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 690' ' ' PHE . . . . . 0.465 ' CG ' ' N ' ' A' ' 691' ' ' ASP . 13.6 p90 -73.49 -44.53 57.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.845 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 691' ' ' ASP . . . . . 0.465 ' N ' ' CG ' ' A' ' 690' ' ' PHE . 8.8 t70 -40.82 139.77 1.14 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.627 0.727 . . . . 0.0 110.861 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . 0.424 ' HD2' ' CG ' ' A' ' 691' ' ' ASP . 53.6 Cg_endo -69.77 -39.17 6.8 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.679 2.253 . . . . 0.0 112.339 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 693' ' ' ARG . . . . . 0.477 ' HA ' ' CD1' ' A' ' 696' ' ' LEU . 79.4 mtm180 -61.36 -27.19 68.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.809 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 694' ' ' TYR . . . . . 0.519 ' CD1' ' C ' ' A' ' 694' ' ' TYR . 1.4 t80 -62.7 -23.62 67.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.923 -179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.418 ' HA ' ' NH2' ' A' ' 702' ' ' ARG . 20.2 mt -91.17 9.26 31.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.953 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 696' ' ' LEU . . . . . 0.477 ' CD1' ' HA ' ' A' ' 693' ' ' ARG . 89.6 mt -89.77 -40.84 12.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.903 179.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 697' ' ' LEU . . . . . 0.471 HD23 ' HE ' ' A' ' 662' ' ' ARG . 60.7 mt -91.97 166.0 12.92 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.894 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 698' ' ' ASN . . . . . 0.503 ' ND2' ' OE2' ' A' ' 701' ' ' GLU . 0.2 OUTLIER -78.58 165.39 50.1 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-O 121.623 0.725 . . . . 0.0 110.89 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 699' ' ' PRO . . . . . 0.401 ' HD2' ' CB ' ' A' ' 698' ' ' ASN . 53.7 Cg_endo -69.77 -26.11 27.88 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.725 2.283 . . . . 0.0 112.353 179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 700' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -72.47 -47.8 45.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.915 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 701' ' ' GLU . . . . . 0.503 ' OE2' ' ND2' ' A' ' 698' ' ' ASN . 0.0 OUTLIER -66.17 -52.75 45.27 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.887 179.954 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 702' ' ' ARG . . . . . 0.449 ' NH2' ' O ' ' A' ' 697' ' ' LEU . 79.8 mtt180 -35.13 -44.66 0.26 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.874 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 703' ' ' LYS . . . . . . . . . . . . . 19.3 tptp -74.48 -48.76 25.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.923 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 704' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -55.81 -57.73 10.83 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.94 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 89.9 t -56.71 -49.86 76.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.112 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 706' ' ' PHE . . . . . 0.512 ' CD2' ' CE3' ' A' ' 681' ' ' TRP . 20.1 t80 -53.22 -41.15 65.09 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.85 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -61.37 -46.19 91.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.866 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -61.03 -39.86 91.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.916 -179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 709' ' ' TYR . . . . . 0.461 ' CE1' ' HG3' ' A' ' 713' ' ' ARG . 22.7 t80 -63.06 -43.25 99.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.917 -179.871 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 710' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 706' ' ' PHE . 86.8 t -63.49 -48.93 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.087 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 711' ' ' LYS . . . . . . . . . . . . . 35.9 tttt -54.11 -48.54 70.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.888 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 712' ' ' THR . . . . . . . . . . . . . 2.3 p -66.58 -37.25 84.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.159 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 713' ' ' ARG . . . . . 0.461 ' HG3' ' CE1' ' A' ' 709' ' ' TYR . 14.2 mmm180 -66.54 -28.24 68.38 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.859 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 714' ' ' ALA . . . . . . . . . . . . . . . -79.18 -54.87 5.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.156 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 715' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -55.33 -33.37 63.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.831 -179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 716' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -91.9 26.37 2.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.874 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 717' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -49.35 100.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.948 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 718' ' ' ARG . . . . . . . . . . . . . 17.6 mtp180 -109.34 162.99 13.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.867 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 719' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -130.95 84.38 2.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.863 -179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 720' ' ' SER . . . . . . . . . . . . . 2.4 t -166.44 163.26 17.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.865 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 721' ' ' GLY . . . . . . . . . . . . . . . 67.68 -163.89 46.36 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.515 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 722' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -179.54 2.99 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.691 2.261 . . . . 0.0 112.318 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 723' ' ' SER . . . . . . . . . . . . . 63.3 p -131.84 133.63 44.88 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.858 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 724' ' ' SER . . . . . . . . . . . . . 72.8 m -100.66 150.68 22.49 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.862 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 725' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.496 -179.974 . . . . . . . . 0 0 . 1 stop_ save_