data_2l0g_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 2l0g _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 ' 680' ' ' PRO . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 N--CA 1.46 -0.475 0 N-CA-C 118.91 2.619 . . . . 0.0 118.91 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 67.6 m -160.17 -40.27 0.05 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.751 1.159 . . . . 0.0 110.815 177.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . 0.455 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 17.1 p-10 -77.55 -63.09 1.46 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.318 1.447 . . . . 0.0 109.343 176.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . 0.455 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 1.4 pt -61.71 116.91 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 C-N-CA 125.49 1.516 . . . . 0.0 110.728 -172.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.53 157.83 63.97 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 168.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -56.72 -42.56 63.69 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.573 2.182 . . . . 0.0 111.093 -169.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -63.86 -43.53 95.81 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 123.728 0.642 . . . . 0.0 110.003 -176.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 15.6 t -65.94 -36.89 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.752 0.821 . . . . 0.0 109.785 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -64.37 -37.9 89.13 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.429 -0.794 . . . . 0.0 111.19 174.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -81.47 -14.38 57.08 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 118.933 0.788 . . . . 0.0 112.658 -178.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -73.63 -16.16 61.24 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.991 1.317 . . . . 0.0 110.723 169.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 81.1 mt -66.97 150.82 97.67 Favored Pre-proline 0 CA--C 1.533 0.306 0 O-C-N 121.521 -0.737 . . . . 0.0 109.186 171.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -54.97 142.46 76.16 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.372 2.048 . . . . 0.0 110.33 173.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.89 -35.68 61.87 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.984 0.914 . . . . 0.0 112.178 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -72.47 -28.66 63.05 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 61.2 t -70.68 -37.46 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 172.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -62.26 -50.37 72.01 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -176.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -49.18 -48.24 45.31 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.79 1.236 . . . . 0.0 113.363 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -41.74 96.33 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 118.527 0.603 . . . . 0.0 110.412 -179.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.98 -32.52 73.88 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.151 -0.968 . . . . 0.0 111.948 175.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.34 -40.35 97.05 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 119.734 1.152 . . . . 0.0 109.885 171.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.12 -34.32 70.95 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.257 176.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.39 -51.71 61.84 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 124.377 1.071 . . . . 0.0 109.598 176.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 21.2 m0 -59.94 -46.31 89.81 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 175.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.6 tptp -69.16 -11.35 60.72 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 120.357 1.435 . . . . 0.0 113.771 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -104.14 5.0 34.73 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 121.417 1.917 . . . . 0.0 111.821 172.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 29.5 p -124.42 -14.96 6.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.56 0.744 . . . . 0.0 112.202 174.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 N-CA-C 106.9 -2.48 . . . . 0.0 106.9 170.352 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo . . . . . 0 CA--C 1.537 0.653 0 CA-C-O 122.394 0.914 . . . . 0.0 113.613 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 2.3 m -48.82 -37.84 20.47 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.446 1.498 . . . . 0.0 114.331 -169.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . 0.435 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 17.1 p-10 -79.75 -70.34 0.52 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.503 1.521 . . . . 0.0 110.887 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . 0.435 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 1.5 pt -62.04 117.25 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 C-N-CA 125.739 1.615 . . . . 0.0 110.846 -170.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.14 160.43 62.9 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 169.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -58.96 -38.29 88.88 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.419 2.079 . . . . 0.0 111.563 -174.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -56.92 -54.62 44.49 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 124.011 0.819 . . . . 0.0 110.019 175.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 11.2 t -65.33 -33.59 64.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 C-N-CA 123.015 0.526 . . . . 0.0 109.618 -174.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 75.7 t80 -68.44 -39.42 81.53 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.985 -0.447 . . . . 0.0 112.139 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -84.34 -16.94 41.12 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.904 0.774 . . . . 0.0 111.653 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -71.81 -13.93 61.83 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.687 1.195 . . . . 0.0 110.41 169.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.02 151.97 96.55 Favored Pre-proline 0 CA--C 1.536 0.408 0 O-C-N 121.436 -0.79 . . . . 0.0 109.349 169.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -55.03 144.12 70.24 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.421 2.08 . . . . 0.0 110.091 175.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . 0.45 ' CD ' ' HZ2' ' A' ' 697' ' ' LYS . 46.2 tp10 -30.87 -63.84 0.14 Allowed 'General case' 0 C--O 1.232 0.146 0 C-N-CA 126.922 2.089 . . . . 0.0 111.328 175.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.58 -23.94 64.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -172.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 80.6 t -69.48 -36.25 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 119.17 0.895 . . . . 0.0 109.374 173.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.417 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 59.6 mt-30 -65.93 -46.32 78.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . 0.45 ' HZ2' ' CD ' ' A' ' 693' ' ' GLU . 12.4 mptt -67.83 -41.92 82.27 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 114.381 -1.281 . . . . 0.0 109.325 -175.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -65.63 -41.36 92.75 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 119.094 -0.479 . . . . 0.0 110.884 176.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -36.29 83.9 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 119.563 1.074 . . . . 0.0 110.696 177.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 44.6 mt -67.42 -41.54 84.68 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.835 0.743 . . . . 0.0 110.204 174.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.46 -37.13 86.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.281 0.491 . . . . 0.0 110.672 173.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -63.88 -55.19 24.59 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.654 1.182 . . . . 0.0 108.315 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -65.85 -7.84 18.59 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.329 -0.857 . . . . 0.0 112.877 175.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . 0.477 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -107.74 2.5 23.74 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.324 169.915 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -119.34 -2.72 10.57 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.667 1.187 . . . . 0.0 112.364 169.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.9 p -115.84 -7.35 12.05 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.48 1.512 . . . . 0.0 110.962 173.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . 0.451 ' C ' ' HZ3' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.246 0.882 0 C-N-CA 130.217 3.77 . . . . 0.0 104.072 169.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo . . . . . 0 N--CA 1.457 -0.638 0 CA-C-O 118.608 -0.663 . . . . 0.0 113.091 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 11.2 m 46.99 26.39 0.59 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.481 1.512 . . . . 0.0 114.779 169.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . 0.267 23.5 t0 51.99 32.63 10.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.719 2.008 . . . . 0.0 114.471 -174.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 22.9 mt -70.52 173.61 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 168.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.41 147.47 37.1 Favored Pre-proline 0 C--N 1.321 -0.646 0 N-CA-C 105.836 -1.912 . . . . 0.0 105.836 169.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -65.33 -34.91 42.61 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 CA-C-N 120.775 1.313 . . . . 0.0 111.549 -169.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -65.61 -48.65 71.54 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 176.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 49.4 t -55.05 -33.71 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 123.5 0.72 . . . . 0.0 110.224 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.42 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 65.6 t80 -75.52 -47.99 24.5 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 178.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -78.56 -11.95 59.99 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.032 -1.043 . . . . 0.0 111.728 -175.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -70.53 -20.47 62.81 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.085 1.354 . . . . 0.0 109.751 168.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 73.3 mt -65.6 151.52 94.41 Favored Pre-proline 0 CA--C 1.533 0.297 0 O-C-N 121.393 -0.817 . . . . 0.0 109.47 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_exo -54.39 146.88 49.37 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.222 2.615 . . . . 0.0 110.031 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.3 tp10 -47.63 -49.5 26.98 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.553 0.741 . . . . 0.0 112.021 -173.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -66.78 -30.45 70.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 93.3 t -68.14 -39.3 81.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 175.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.42 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 73.6 mt-30 -64.07 -45.13 90.14 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 122.315 1.055 . . . . 0.0 108.214 -178.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.08 -52.42 65.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.42 -1.263 . . . . 0.0 109.917 -178.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -64.64 -36.74 85.23 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 118.941 0.791 . . . . 0.0 111.599 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -38.61 86.18 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.018 0.826 . . . . 0.0 110.33 177.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 31.0 mt -68.49 -38.07 80.66 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 119.546 1.066 . . . . 0.0 110.42 174.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.49 -38.84 92.69 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.685 0.675 . . . . 0.0 110.242 173.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.27 -55.33 33.18 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 124.164 0.985 . . . . 0.0 108.775 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -67.16 -6.22 16.88 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.088 -1.007 . . . . 0.0 112.841 177.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -110.3 3.01 19.5 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.402 1.001 . . . . 0.0 112.903 170.321 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -117.96 -9.55 10.57 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.528 1.131 . . . . 0.0 112.319 169.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.5 p -108.87 -5.68 16.09 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.465 1.506 . . . . 0.0 111.518 173.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . 0.469 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.252 1.271 0 N-CA-C 104.32 -3.512 . . . . 0.0 104.32 169.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo . . . . . 0 CA--C 1.545 1.064 0 CA-C-O 121.559 0.566 . . . . 0.0 112.243 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 12.9 m -145.64 9.0 1.17 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.191 -1.568 . . . . 0.0 112.942 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -77.37 -0.65 26.5 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.704 1.602 . . . . 0.0 111.933 169.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 8.8 pt -145.05 163.14 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 C-N-CA 127.436 2.294 . . . . 0.0 108.479 -172.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.75 150.42 37.71 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 125.331 1.452 . . . . 0.0 107.207 170.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -66.53 -37.48 22.38 Favored 'Trans proline' 0 N--CA 1.452 -0.957 0 C-N-CA 123.0 2.466 . . . . 0.0 113.413 -173.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 19.5 mm100 -68.25 -46.66 69.87 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 86.1 t -56.37 -40.51 67.26 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -64.26 -52.71 57.34 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 173.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -69.33 -26.13 64.55 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.572 1.078 . . . . 0.0 111.569 -171.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -71.13 -7.82 49.24 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.818 1.647 . . . . 0.0 112.461 171.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 51.6 mt -65.07 153.83 88.16 Favored Pre-proline 0 CA--C 1.537 0.47 0 O-C-N 120.746 -1.221 . . . . 0.0 109.62 169.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -53.63 142.45 60.73 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.405 2.737 . . . . 0.0 109.851 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -48.75 -41.51 32.41 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 123.683 0.793 . . . . 0.0 112.786 -172.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -73.65 -31.69 63.62 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 72.8 t -66.2 -48.17 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 170.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -55.03 -43.56 73.83 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 123.854 0.862 . . . . 0.0 110.919 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.41 -45.41 91.11 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 117.537 -1.22 . . . . 0.0 110.459 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -71.02 -39.92 72.06 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.742 1.156 . . . . 0.0 111.342 -177.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.36 -44.97 89.76 Favored 'General case' 0 C--O 1.226 -0.163 0 O-C-N 121.47 -0.769 . . . . 0.0 110.974 175.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 61.3 mt -58.15 -39.86 79.88 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 119.147 0.885 . . . . 0.0 109.821 173.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -64.92 -44.67 88.77 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 117.412 -1.28 . . . . 0.0 111.089 178.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.98 -50.48 64.04 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.639 1.563 . . . . 0.0 108.825 172.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 49.6 m0 -68.23 -9.04 44.29 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.026 1.33 . . . . 0.0 113.532 -177.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -110.31 -3.36 16.25 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.734 0.814 . . . . 0.0 112.182 169.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -91.32 -6.61 52.81 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.208 0.913 . . . . 0.0 109.509 168.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 54.4 p -131.08 4.63 4.44 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 114.131 1.159 . . . . 0.0 114.131 -169.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 N-CA-C 106.312 -2.715 . . . . 0.0 106.312 -176.052 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo . . . . . 0 CA--C 1.535 0.537 0 N-CA-C 114.906 1.079 . . . . 0.0 114.906 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.7 m -40.6 -39.33 1.03 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.651 1.98 . . . . 0.0 116.32 -169.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 16.4 p-10 -82.27 -69.05 0.65 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.972 1.309 . . . . 0.0 110.517 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.5 pt -62.38 160.46 2.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 125.807 1.643 . . . . 0.0 112.577 -172.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.57 166.48 20.66 Favored Pre-proline 0 N--CA 1.464 0.257 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 169.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -54.81 -37.99 92.24 Favored 'Trans proline' 0 CA--C 1.505 -0.973 0 C-N-CA 122.553 2.169 . . . . 0.0 113.725 -168.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -61.6 -54.84 37.58 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 13.9 t -65.89 -34.18 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 124.471 1.108 . . . . 0.0 109.811 -173.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.42 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 66.6 t80 -72.31 -37.4 68.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 122.906 0.482 . . . . 0.0 111.848 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -83.07 -16.86 45.28 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.547 0.612 . . . . 0.0 111.301 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -71.56 -12.55 61.42 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.544 1.138 . . . . 0.0 110.872 169.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 69.7 mt -73.61 152.44 89.5 Favored Pre-proline 0 CA--C 1.539 0.538 0 O-C-N 121.313 -0.867 . . . . 0.0 109.766 174.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -56.47 155.64 24.92 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 123.194 2.596 . . . . 0.0 111.528 172.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -42.07 46.9 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.527 0.731 . . . . 0.0 110.81 176.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -62.11 -53.46 55.16 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 -176.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 41.3 t -60.15 -32.47 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.476 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.42 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.9 mt-30 -68.84 -55.9 9.69 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 120.071 1.305 . . . . 0.0 108.606 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . 0.335 0.0 OUTLIER -74.24 -30.79 62.32 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.248 -169.404 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -68.23 -39.97 82.15 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 119.671 1.123 . . . . 0.0 109.101 170.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -36.94 85.72 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.561 1.073 . . . . 0.0 110.116 174.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 15.1 mt -62.47 -42.26 99.36 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 119.114 0.87 . . . . 0.0 110.143 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.0 -42.17 81.15 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.869 0.759 . . . . 0.0 110.827 178.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -59.26 -53.19 61.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.142 1.377 . . . . 0.0 109.454 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -66.88 -32.15 73.22 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 118.408 -0.806 . . . . 0.0 110.923 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . 0.467 ' HZ2' ' C ' ' A' ' 707' ' ' GLY . 0.2 OUTLIER -60.72 -25.94 66.81 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 119.566 1.075 . . . . 0.0 111.829 174.254 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -64.44 -12.39 43.01 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.963 1.256 . . . . 0.0 113.543 170.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 1.9 p -130.17 -17.36 3.45 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -169.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . 0.467 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.247 0.934 0 N-CA-C 105.903 -2.879 . . . . 0.0 105.903 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo . . . . . 0 CA--C 1.537 0.637 0 CA-C-O 121.15 0.396 . . . . 0.0 112.288 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 2.2 m -45.96 -39.34 8.8 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 114.781 1.401 . . . . 0.0 114.781 -168.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . 0.477 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 11.7 p-10 -66.15 -85.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.885 2.074 . . . . 0.0 111.021 173.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . 0.477 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 4.0 pt -55.16 118.21 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 C-N-CA 125.533 1.533 . . . . 0.0 110.107 -169.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.6 152.78 67.34 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 170.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -57.38 -37.17 98.32 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.163 2.575 . . . . 0.0 111.771 -169.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -56.41 -55.37 34.37 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 5.2 t -60.82 -37.28 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 C-N-CA 124.532 1.133 . . . . 0.0 109.607 -176.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.462 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 72.0 t80 -69.61 -40.76 76.43 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 119.068 -0.491 . . . . 0.0 112.029 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -77.0 -20.29 56.23 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.456 1.026 . . . . 0.0 111.281 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -70.52 -11.22 60.79 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.282 1.033 . . . . 0.0 111.524 169.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 83.1 mt -70.59 152.32 95.34 Favored Pre-proline 0 CA--C 1.535 0.379 0 O-C-N 121.057 -1.027 . . . . 0.0 109.139 169.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -53.98 147.34 43.25 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.464 2.109 . . . . 0.0 110.162 175.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . 0.468 ' CD ' ' HZ3' ' A' ' 697' ' ' LYS . 41.0 tp10 -40.95 -57.51 1.97 Allowed 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.069 1.348 . . . . 0.0 111.05 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.01 -25.04 63.4 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -173.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 78.9 t -67.31 -45.14 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.462 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 62.9 mt-30 -55.53 -43.24 75.59 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.249 0.547 . . . . 0.0 109.645 178.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . 0.468 ' HZ3' ' CD ' ' A' ' 693' ' ' GLU . 11.7 mptt -74.21 -40.75 62.25 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.218 -173.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -62.99 -40.08 96.7 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 119.219 0.918 . . . . 0.0 110.862 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.3 -38.61 91.65 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 119.468 1.031 . . . . 0.0 111.272 177.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.19 -44.38 84.15 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.923 0.783 . . . . 0.0 110.116 174.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.13 82.9 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 119.148 -0.453 . . . . 0.0 110.58 174.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.75 -54.83 33.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.463 1.105 . . . . 0.0 108.113 178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 22.1 m0 -65.73 -2.84 4.0 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.285 1.034 . . . . 0.0 113.045 176.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -117.13 5.06 12.71 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.861 1.209 . . . . 0.0 113.759 169.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 19.1 ptt180 -117.93 9.46 12.84 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.638 1.175 . . . . 0.0 111.461 169.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 28.8 p -125.9 -3.56 7.06 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.206 1.402 . . . . 0.0 111.884 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.577 0 N-CA-C 105.388 -3.085 . . . . 0.0 105.388 -172.645 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 CA--C 1.54 0.814 0 N-CA-C 114.826 1.048 . . . . 0.0 114.826 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 4.2 m -60.67 -30.3 69.83 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.418 1.087 . . . . 0.0 113.539 -172.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -69.06 -9.94 55.07 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.848 2.459 . . . . 0.0 114.111 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 13.1 pt -145.82 -178.24 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 125.549 1.54 . . . . 0.0 108.323 -174.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -152.03 162.75 25.73 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 168.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -57.51 -36.71 98.65 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.213 1.942 . . . . 0.0 113.577 -168.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -62.37 -53.46 54.71 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -177.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 4.1 t -68.73 -33.19 58.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.748 -173.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.45 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 66.6 t80 -65.73 -39.39 91.09 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 118.391 0.541 . . . . 0.0 111.161 177.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -81.4 -16.6 51.67 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.68 -0.638 . . . . 0.0 111.551 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -75.18 -13.22 60.44 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.168 0.894 . . . . 0.0 110.832 169.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 64.6 mt -68.84 152.32 96.82 Favored Pre-proline 0 C--N 1.344 0.357 0 O-C-N 121.075 -1.016 . . . . 0.0 109.216 170.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -53.65 144.74 51.74 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.382 2.055 . . . . 0.0 110.745 173.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.05 -34.35 65.82 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.598 0.759 . . . . 0.0 112.791 -176.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.5 -38.78 74.38 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.701 -0.624 . . . . 0.0 112.49 173.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 96.2 t -61.53 -37.11 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 O-C-N 120.88 -1.137 . . . . 0.0 109.559 175.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.45 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 68.5 mt-30 -58.52 -53.93 52.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -51.75 -52.44 48.65 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.19 -36.14 79.11 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -171.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.03 -38.67 89.59 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.495 171.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.75 -38.35 87.66 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-N 119.425 1.012 . . . . 0.0 110.343 173.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.47 72.67 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.561 0.619 . . . . 0.0 110.901 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -60.44 -52.28 65.9 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 176.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.4 m0 -58.61 -46.1 87.75 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 118.531 -0.747 . . . . 0.0 110.06 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -68.13 -19.56 64.83 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 120.405 1.457 . . . . 0.0 112.643 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -84.87 -4.68 59.2 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 120.692 1.587 . . . . 0.0 113.083 169.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 37.5 p -126.3 -15.26 5.74 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.165 1.348 . . . . 0.0 112.325 -171.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.975 0 N-CA-C 106.282 -2.727 . . . . 0.0 106.282 169.869 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo . . . . . 0 CA--C 1.536 0.621 0 N-CA-C 114.869 1.065 . . . . 0.0 114.869 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 5.0 m -55.55 -27.37 48.59 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.173 1.545 . . . . 0.0 115.173 -169.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -91.03 -7.78 50.91 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.615 1.966 . . . . 0.0 113.512 -172.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.3 pt -140.05 170.27 15.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 125.72 1.608 . . . . 0.0 108.569 -174.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -151.82 170.04 8.53 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 168.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -54.58 -37.12 90.64 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.056 1.837 . . . . 0.0 113.062 -168.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -61.6 -55.73 27.58 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.47 -36.51 76.54 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 C-N-CA 124.833 1.253 . . . . 0.0 109.93 -172.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -73.49 -37.58 65.68 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.836 -0.54 . . . . 0.0 111.315 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -81.36 -16.17 53.09 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.805 -0.559 . . . . 0.0 110.936 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -73.3 -13.43 61.12 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.343 1.057 . . . . 0.0 110.762 169.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 69.2 mt -73.72 152.86 89.34 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.142 -0.974 . . . . 0.0 109.108 172.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -54.69 142.54 72.75 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.076 1.851 . . . . 0.0 110.611 172.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.63 -33.91 64.45 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.583 0.753 . . . . 0.0 112.098 -179.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -72.45 -30.51 64.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.341 -0.849 . . . . 0.0 113.205 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 64.4 t -69.0 -42.44 82.11 Favored 'Isoleucine or valine' 0 C--O 1.23 0.051 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 172.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -54.82 -49.87 69.97 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -54.39 -46.98 73.19 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 175.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.62 -40.25 95.15 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.625 0.648 . . . . 0.0 110.499 -177.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.86 -32.65 73.93 Favored 'General case' 0 C--N 1.332 -0.152 0 C-N-CA 124.224 1.01 . . . . 0.0 111.375 175.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 18.8 mt -65.7 -41.54 92.24 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 120.066 1.303 . . . . 0.0 110.261 170.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.78 -38.35 90.76 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.45 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -59.58 -55.3 36.25 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 119.103 0.865 . . . . 0.0 109.43 173.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -71.62 4.87 2.77 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.214 -0.929 . . . . 0.0 112.638 177.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . 0.488 ' HZ2' ' C ' ' A' ' 707' ' ' GLY 0.266 1.2 tppm? -124.4 10.79 8.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.588 1.155 . . . . 0.0 112.617 169.064 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -122.51 4.99 9.59 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.815 1.246 . . . . 0.0 110.98 168.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 32.5 p -121.6 -6.91 9.17 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.453 1.501 . . . . 0.0 111.656 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . 0.488 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.245 0.831 0 N-CA-C 105.531 -3.028 . . . . 0.0 105.531 -176.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo . . . . . 0 CA--C 1.546 1.101 0 CA-C-O 120.769 0.237 . . . . 0.0 111.636 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 70.3 p -135.38 49.24 2.19 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.589 1.156 . . . . 0.0 109.248 -176.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.4 -58.39 0.13 Allowed 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.396 1.078 . . . . 0.0 109.383 -169.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 12.8 pt -69.93 128.97 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 123.565 0.746 . . . . 0.0 109.025 169.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -73.83 139.62 77.13 Favored Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 168.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.83 -37.09 97.66 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.698 2.266 . . . . 0.0 112.017 -174.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -68.88 -41.19 78.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.069 -0.491 . . . . 0.0 109.68 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 99.7 t -62.41 -40.74 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.462 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 84.5 t80 -62.45 -40.17 95.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 121.344 -0.847 . . . . 0.0 112.376 173.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -76.91 -10.86 59.65 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.488 -0.758 . . . . 0.0 111.998 -178.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -72.98 -21.27 60.87 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.502 1.047 . . . . 0.0 110.3 168.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 83.7 mt -61.25 151.16 77.24 Favored Pre-proline 0 CA--C 1.536 0.409 0 O-C-N 121.092 -1.005 . . . . 0.0 109.658 175.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -54.06 148.05 41.09 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 123.12 2.547 . . . . 0.0 110.981 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . 0.418 ' CD ' ' HZ1' ' A' ' 697' ' ' LYS . 48.3 tp10 -34.06 -62.89 0.3 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 126.367 1.867 . . . . 0.0 111.331 176.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.48 -27.45 64.22 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -172.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 72.7 t -64.97 -45.62 94.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 174.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.462 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 60.1 mt-30 -56.84 -49.59 74.98 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . 0.418 ' HZ1' ' CD ' ' A' ' 693' ' ' GLU . 12.9 mptt -67.21 -33.04 74.52 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 116.93 -1.51 . . . . 0.0 111.893 -169.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -67.1 -50.5 61.38 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.244 1.384 . . . . 0.0 109.706 172.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -59.0 -38.74 79.9 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.396 0.998 . . . . 0.0 111.652 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 45.5 mt -67.99 -43.49 78.79 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.719 0.808 . . . . 0.0 109.994 176.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.25 -28.47 66.34 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.635 -0.698 . . . . 0.0 111.515 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -66.87 -61.35 2.0 Allowed 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 170.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.3 m0 -57.89 -20.55 37.66 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 117.339 -1.315 . . . . 0.0 112.071 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 4.2 mmpm? -89.28 -34.22 16.67 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 122.252 2.296 . . . . 0.0 112.794 169.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 7.5 ptp85 -65.64 -19.86 66.08 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 120.871 1.669 . . . . 0.0 110.744 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 24.3 p -106.38 21.33 17.58 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.788 1.235 . . . . 0.0 111.982 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 CA-C-O 118.358 -1.246 . . . . 0.0 110.258 175.023 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.271 0.0 OUTLIER . . . . . 0 N--CA 1.463 -0.305 0 N-CA-C 119.669 2.911 . . . . 0.0 119.669 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 59.1 m -160.91 -41.67 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 120.071 1.305 . . . . 0.0 110.463 172.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 19.2 p-10 -81.15 -61.54 1.92 Allowed 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.946 1.698 . . . . 0.0 109.217 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 3.4 pt -62.33 156.66 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 125.249 1.419 . . . . 0.0 111.605 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -137.94 165.85 30.56 Favored Pre-proline 0 C--N 1.329 -0.298 0 C-N-CA 126.803 2.041 . . . . 0.0 105.898 172.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -58.33 -36.32 97.76 Favored 'Trans proline' 0 CA--C 1.508 -0.775 0 C-N-CA 123.089 2.526 . . . . 0.0 113.795 -168.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -62.36 -54.7 36.55 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 17.8 t -60.08 -39.47 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.073 0 C-N-CA 124.981 1.312 . . . . 0.0 109.25 -174.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.421 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 68.7 t80 -70.52 -39.32 74.14 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.808 -177.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -82.84 -16.23 48.49 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.032 0.833 . . . . 0.0 111.234 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -71.24 -11.66 61.04 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.529 1.131 . . . . 0.0 110.656 168.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 53.6 mt -76.5 152.4 83.41 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 124.027 0.931 . . . . 0.0 109.284 171.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -56.2 146.99 68.44 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.944 2.429 . . . . 0.0 110.947 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -46.76 -49.91 18.99 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.075 0.95 . . . . 0.0 112.003 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.55 -28.28 67.66 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -177.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 81.8 t -69.48 -36.93 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 CA-C-N 118.747 0.703 . . . . 0.0 109.493 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.421 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 70.7 mt-30 -65.38 -46.45 80.05 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.231 1.015 . . . . 0.0 108.365 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -50.26 74.54 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.607 178.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.82 -39.52 90.94 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 123.32 0.648 . . . . 0.0 111.515 -175.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -40.81 95.67 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 121.283 -0.885 . . . . 0.0 109.81 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 40.3 mt -65.36 -41.14 94.12 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.085 0.857 . . . . 0.0 110.409 174.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.74 -40.7 93.4 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.963 -0.542 . . . . 0.0 110.446 175.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.28 -54.86 38.64 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.014 0.925 . . . . 0.0 108.824 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -67.46 0.8 2.7 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.347 1.059 . . . . 0.0 113.066 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . 0.467 ' HZ3' ' C ' ' A' ' 707' ' ' GLY . 0.3 OUTLIER -122.14 7.16 9.71 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.425 1.011 . . . . 0.0 113.19 169.385 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -118.4 13.28 13.54 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.563 1.145 . . . . 0.0 111.52 170.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 23.3 p -129.92 -7.12 4.46 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.235 1.414 . . . . 0.0 111.958 -176.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . 0.467 ' C ' ' HZ3' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.247 0.947 0 N-CA-C 104.332 -3.507 . . . . 0.0 104.332 -169.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo . . . . . 0 N--CA 1.457 -0.656 0 CA-C-O 121.708 0.628 . . . . 0.0 113.668 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.3 m -44.13 -41.55 5.73 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.711 1.604 . . . . 0.0 114.847 -169.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 9.2 p-10 -69.74 -81.37 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.289 2.236 . . . . 0.0 112.084 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . 0.451 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 2.7 pt -53.08 114.14 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 C-N-CA 127.212 2.205 . . . . 0.0 112.842 -169.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.9 145.44 98.92 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 168.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -59.48 -31.63 94.99 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.075 1.85 . . . . 0.0 112.142 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -66.51 -45.87 78.1 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 45.0 t -59.96 -42.36 89.2 Favored 'Isoleucine or valine' 0 C--N 1.342 0.281 0 C-N-CA 123.642 0.777 . . . . 0.0 109.435 174.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -62.25 -39.64 93.52 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.544 -176.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -82.28 -16.09 50.68 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.19 0.904 . . . . 0.0 112.334 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -71.28 -23.3 61.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.497 0.719 . . . . 0.0 110.346 169.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 85.5 mt -58.69 147.17 72.05 Favored Pre-proline 0 CA--C 1.538 0.482 0 O-C-N 121.115 -0.991 . . . . 0.0 109.604 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -54.92 147.78 50.21 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.457 2.105 . . . . 0.0 110.476 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -49.46 -48.31 47.68 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.481 0.712 . . . . 0.0 111.466 -175.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.37 -26.24 64.57 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.707 1.002 . . . . 0.0 113.707 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 69.7 t -71.4 -37.97 66.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 118.889 0.768 . . . . 0.0 109.277 172.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.36 -47.45 79.27 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 122.565 1.174 . . . . 0.0 107.849 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.03 -46.35 91.06 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.276 -1.329 . . . . 0.0 109.893 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.79 -39.88 91.39 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 118.733 0.697 . . . . 0.0 111.138 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -40.23 96.58 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.198 0.908 . . . . 0.0 110.396 175.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 47.5 mt -66.9 -39.81 87.52 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.463 -0.773 . . . . 0.0 110.528 175.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.87 -38.45 91.15 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.606 0.639 . . . . 0.0 110.512 174.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -62.19 -54.57 39.09 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.694 1.197 . . . . 0.0 108.428 177.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.5 m0 -66.5 -6.6 15.43 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.246 -0.909 . . . . 0.0 113.225 176.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . 0.483 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -108.96 1.56 20.75 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 117.979 -1.01 . . . . 0.0 113.06 169.735 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -117.92 -3.08 11.2 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.751 1.221 . . . . 0.0 112.661 169.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.7 p -116.16 -8.12 11.79 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.578 1.551 . . . . 0.0 110.973 174.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . 0.45 ' C ' ' HZ1' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.255 1.458 0 C-N-CA 130.099 3.714 . . . . 0.0 104.091 169.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo . . . . . 0 CA--C 1.533 0.432 0 N-CA-C 115.853 1.444 . . . . 0.0 115.853 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 29.0 m 115.11 -6.35 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 130.971 3.709 . . . . 0.0 109.916 -170.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -68.7 -13.72 62.55 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.507 1.923 . . . . 0.0 111.019 168.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 10.1 pt -135.2 146.57 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.992 0 C-N-CA 127.258 2.223 . . . . 0.0 109.342 -176.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -91.23 143.89 29.02 Favored Pre-proline 0 CA--C 1.541 0.615 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 167.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -57.62 -40.38 80.51 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.718 2.279 . . . . 0.0 112.561 -174.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -68.35 -43.85 76.53 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.38 -40.52 88.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 84.2 t80 -58.66 -38.64 78.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 121.681 -0.637 . . . . 0.0 112.096 176.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -80.68 -15.91 55.34 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.858 0.754 . . . . 0.0 112.727 -179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -73.36 -19.97 60.88 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.333 0.97 . . . . 0.0 110.813 169.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.77 148.82 66.82 Favored Pre-proline 0 CA--C 1.536 0.411 0 O-C-N 120.905 -1.122 . . . . 0.0 109.463 172.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -54.34 147.29 46.99 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 122.483 2.122 . . . . 0.0 110.576 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . 0.485 ' CD ' ' HZ3' ' A' ' 697' ' ' LYS . 45.1 tp10 -38.11 -58.56 0.95 Allowed 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 125.461 1.504 . . . . 0.0 110.945 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.83 -25.09 62.68 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -173.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.41 -43.47 87.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 119.351 0.978 . . . . 0.0 108.595 173.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 66.7 mt-30 -57.49 -45.5 84.83 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . 0.485 ' HZ3' ' CD ' ' A' ' 693' ' ' GLU . 11.5 mptt -71.78 -33.89 68.98 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.529 -174.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -66.63 -46.45 75.79 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.324 1.05 . . . . 0.0 111.213 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.63 -43.08 99.52 Favored 'General case' 0 N--CA 1.461 0.097 0 O-C-N 121.412 -0.805 . . . . 0.0 110.168 177.198 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.01 -41.07 91.33 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.928 -0.482 . . . . 0.0 111.008 172.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -59.48 -48.14 82.79 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 117.666 -1.159 . . . . 0.0 109.806 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -62.05 -45.63 92.72 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 120.348 1.431 . . . . 0.0 111.449 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 31.1 m0 -63.62 -14.13 48.74 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 120.501 -1.374 . . . . 0.0 112.506 175.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . 0.443 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.6 OUTLIER -101.74 -17.85 16.08 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.726 1.211 . . . . 0.0 112.928 169.56 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -67.77 -41.29 83.5 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 121.412 1.915 . . . . 0.0 109.033 171.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 17.7 p -73.38 24.33 0.07 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.913 2.085 . . . . 0.0 113.539 -172.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . 0.403 ' C ' ' HZ1' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.251 1.202 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 -172.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.279 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.42 0 N-CA-C 118.664 2.524 . . . . 0.0 118.664 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 69.0 m -158.76 -39.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.785 1.175 . . . . 0.0 110.507 177.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . 0.517 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 19.0 p-10 -75.75 -74.22 0.23 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.541 1.536 . . . . 0.0 108.688 171.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . 0.517 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 6.2 pt -58.44 156.53 2.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 C-N-CA 126.422 1.889 . . . . 0.0 111.681 -176.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -141.68 169.9 10.28 Favored Pre-proline 0 C--N 1.331 -0.201 0 C-N-CA 125.786 1.634 . . . . 0.0 106.806 169.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -55.29 -36.2 93.06 Favored 'Trans proline' 0 CA--C 1.506 -0.905 0 C-N-CA 122.567 2.178 . . . . 0.0 113.81 -168.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -63.14 -56.08 19.81 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 11.9 t -61.78 -37.39 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 C-N-CA 124.305 1.042 . . . . 0.0 109.546 -173.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.434 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 75.8 t80 -75.32 -40.83 58.02 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 123.345 0.658 . . . . 0.0 111.341 -176.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -82.05 -14.1 56.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.059 0.845 . . . . 0.0 110.934 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -74.36 -9.67 58.83 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.834 1.254 . . . . 0.0 110.325 168.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 54.3 mt -76.34 152.92 83.96 Favored Pre-proline 0 CA--C 1.534 0.339 0 O-C-N 121.499 -0.751 . . . . 0.0 109.144 170.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -55.6 146.7 63.23 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.755 2.303 . . . . 0.0 110.653 177.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -46.39 -49.81 17.44 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 124.249 1.02 . . . . 0.0 111.943 -176.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.46 -28.12 66.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.316 -0.85 . . . . 0.0 113.237 -177.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 90.6 t -68.93 -38.05 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 118.922 0.783 . . . . 0.0 109.406 172.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 72.8 mt-30 -63.99 -47.7 79.33 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 -178.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.58 -46.54 89.85 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.08 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -62.66 -43.11 99.64 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.11 0.964 . . . . 0.0 111.63 -178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.0 -39.27 90.16 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.385 0.674 . . . . 0.0 110.247 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 36.0 mt -63.4 -41.37 98.75 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 118.909 0.777 . . . . 0.0 110.243 172.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.75 97.78 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.958 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -61.35 -47.09 87.49 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 119.371 0.987 . . . . 0.0 110.825 177.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 25.0 m0 -68.93 0.05 4.96 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.315 -0.866 . . . . 0.0 112.618 173.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . 0.513 ' HZ3' ' C ' ' A' ' 707' ' ' GLY . 1.2 tppm? -117.56 3.66 12.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.358 1.463 . . . . 0.0 112.175 168.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -95.17 -11.4 28.17 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.911 1.285 . . . . 0.0 109.53 168.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 17.1 p -122.58 -3.68 8.79 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.565 1.146 . . . . 0.0 113.69 -168.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . 0.513 ' C ' ' HZ3' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.251 1.162 0 N-CA-C 106.158 -2.777 . . . . 0.0 106.158 -175.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo . . . . . 0 CA--C 1.537 0.634 0 N-CA-C 113.642 0.593 . . . . 0.0 113.642 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . 0.258 26.6 m 76.06 8.0 3.54 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 127.152 2.181 . . . . 0.0 113.291 174.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -74.76 -40.05 61.43 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 167.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 14.1 pt -76.0 127.22 37.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 127.204 2.202 . . . . 0.0 107.92 168.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -72.49 141.6 83.08 Favored Pre-proline 0 CA--C 1.543 0.677 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 167.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.84 -37.47 96.2 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.499 2.133 . . . . 0.0 112.057 -173.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -69.26 -42.75 75.15 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 64.9 t -59.75 -40.15 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 C-N-CA 123.359 0.664 . . . . 0.0 109.455 176.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.456 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 74.4 t80 -62.7 -42.41 99.63 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.378 -0.826 . . . . 0.0 112.016 176.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -75.96 -12.03 60.07 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.941 0.791 . . . . 0.0 112.182 -178.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -73.43 -20.75 60.64 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.446 1.021 . . . . 0.0 110.12 168.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 87.3 mt -60.07 151.04 67.84 Favored Pre-proline 0 CA--C 1.536 0.439 0 O-C-N 120.885 -1.134 . . . . 0.0 109.205 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -54.93 148.06 48.93 Favored 'Trans proline' 0 N--CA 1.452 -0.935 0 C-N-CA 122.607 2.205 . . . . 0.0 110.446 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . 0.514 ' CD ' ' HZ2' ' A' ' 697' ' ' LYS . 45.8 tp10 -41.32 -57.47 2.13 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.055 1.342 . . . . 0.0 111.262 -179.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.8 -27.96 66.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -174.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 98.9 t -67.76 -45.1 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 176.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.456 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 70.0 mt-30 -55.36 -44.5 76.06 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 122.024 0.916 . . . . 0.0 109.318 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . 0.514 ' HZ2' ' CD ' ' A' ' 693' ' ' GLU . 9.1 mptt -69.87 -41.37 74.9 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 117.622 -1.18 . . . . 0.0 110.347 -171.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -69.9 -43.77 71.07 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 119.614 1.097 . . . . 0.0 111.022 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -56.39 -46.56 80.06 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.877 0.762 . . . . 0.0 110.941 174.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 32.2 mt -69.03 -33.97 74.47 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.472 -0.767 . . . . 0.0 111.461 178.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.99 -34.74 73.74 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 119.257 0.935 . . . . 0.0 110.903 176.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -67.73 -51.81 44.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.349 1.06 . . . . 0.0 109.007 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -59.94 -34.09 72.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 120.965 -1.084 . . . . 0.0 110.9 176.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . 0.437 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.3 OUTLIER -74.99 -35.63 62.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 117.666 -1.159 . . . . 0.0 112.777 175.173 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -74.71 -14.02 60.68 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 120.877 1.671 . . . . 0.0 111.899 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 36.0 p -103.7 18.94 20.82 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.279 1.032 . . . . 0.0 111.938 -178.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.856 0 CA-C-O 117.188 -1.895 . . . . 0.0 108.724 179.098 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo . . . . . 0 CA--C 1.539 0.744 0 N-CA-C 116.127 1.549 . . . . 0.0 116.127 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.8 m -49.68 -29.87 8.14 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.732 1.613 . . . . 0.0 115.121 -169.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -90.15 -68.5 0.78 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.664 1.586 . . . . 0.0 110.789 177.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.5 pt -66.61 162.1 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 125.877 1.671 . . . . 0.0 113.083 -171.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -140.84 166.29 23.81 Favored Pre-proline 0 N--CA 1.468 0.467 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 169.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -56.9 -34.67 97.57 Favored 'Trans proline' 0 CA--C 1.505 -0.958 0 C-N-CA 122.533 2.156 . . . . 0.0 113.666 -168.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -63.38 -55.71 22.19 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -178.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 17.6 t -65.93 -34.46 70.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 124.218 1.007 . . . . 0.0 109.431 -173.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.438 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 79.5 t80 -70.74 -41.74 71.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 121.893 -0.504 . . . . 0.0 111.495 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -82.63 -13.75 55.93 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.232 0.924 . . . . 0.0 111.015 -179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -71.59 -17.17 62.3 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.36 1.064 . . . . 0.0 109.954 168.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 70.4 mt -66.55 152.51 94.83 Favored Pre-proline 0 C--N 1.344 0.364 0 O-C-N 121.199 -0.938 . . . . 0.0 109.765 174.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -55.06 147.12 54.92 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.023 2.482 . . . . 0.0 110.252 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -46.62 -50.74 17.11 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 124.181 0.993 . . . . 0.0 112.436 -172.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.0 93.35 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 57.8 t -61.23 -38.09 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 O-C-N 121.357 -0.839 . . . . 0.0 109.531 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.438 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 60.8 mt-30 -64.0 -48.12 77.65 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.222 0.465 . . . . 0.0 110.468 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.6 -48.53 80.52 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -176.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.51 -37.03 76.99 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 122.736 0.414 . . . . 0.0 110.344 -173.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.55 -42.53 91.75 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.829 0.741 . . . . 0.0 110.192 175.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.03 -40.68 94.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.796 0.725 . . . . 0.0 110.711 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.59 -38.23 70.89 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.57 0.623 . . . . 0.0 111.912 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 39.8 tp10 -69.42 -41.65 76.07 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.43 1.092 . . . . 0.0 110.099 -179.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -61.31 -45.33 94.91 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.185 -0.947 . . . . 0.0 109.087 170.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.5 tptp -60.83 -24.51 65.93 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.504 1.047 . . . . 0.0 112.96 176.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -73.01 -11.73 60.67 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.307 1.043 . . . . 0.0 112.166 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.57 -13.46 1.99 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -168.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.848 0 N-CA-C 105.072 -3.211 . . . . 0.0 105.072 170.188 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo . . . . . 0 CA--C 1.534 0.489 0 N-CA-C 113.441 0.516 . . . . 0.0 113.441 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 15.2 m 67.27 15.45 9.97 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.88 1.672 . . . . 0.0 113.692 173.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -76.76 -41.09 46.15 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.605 1.562 . . . . 0.0 107.577 168.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.1 pt -81.89 139.2 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 C-N-CA 128.021 2.528 . . . . 0.0 108.301 169.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -73.57 144.2 83.2 Favored Pre-proline 0 CA--C 1.542 0.66 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 168.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -60.66 -38.07 74.66 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 121.727 1.618 . . . . 0.0 111.526 -175.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -63.62 -47.39 81.61 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 58.4 t -61.71 -37.12 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -176.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.433 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 86.5 t80 -62.83 -47.49 83.2 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.389 -0.82 . . . . 0.0 112.235 171.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -74.22 -14.22 60.9 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.204 -0.935 . . . . 0.0 111.701 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -73.82 -14.54 61.11 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.676 1.19 . . . . 0.0 110.646 169.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 77.3 mt -64.77 152.74 89.64 Favored Pre-proline 0 CA--C 1.537 0.445 0 O-C-N 121.022 -1.049 . . . . 0.0 109.697 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -55.3 144.07 73.17 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.139 2.559 . . . . 0.0 109.945 177.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -44.94 -50.09 10.71 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.613 1.165 . . . . 0.0 112.079 -174.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.46 -32.3 73.05 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 97.4 t -67.11 -40.1 84.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 176.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.433 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 74.0 mt-30 -62.54 -48.67 78.51 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 -177.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -45.04 79.53 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.114 -175.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -67.5 -43.18 81.52 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.02 0.827 . . . . 0.0 111.598 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -63.06 -35.98 82.07 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 120.988 -1.07 . . . . 0.0 112.249 174.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 39.9 mt -69.7 -38.2 76.88 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 177.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.48 -36.84 83.76 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.684 -0.674 . . . . 0.0 110.352 173.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -63.8 -54.08 40.8 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.528 1.131 . . . . 0.0 109.456 176.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 31.3 m0 -62.36 -25.34 67.86 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 120.846 -1.159 . . . . 0.0 111.587 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . 0.44 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.5 OUTLIER -81.39 -32.81 32.66 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 117.177 -1.392 . . . . 0.0 112.766 173.28 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -82.34 -27.51 32.16 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.977 1.717 . . . . 0.0 111.432 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 27.9 p -86.72 155.36 20.39 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.91 0 N-CA-C 107.422 -2.271 . . . . 0.0 107.422 168.867 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo . . . . . 0 CA--C 1.535 0.536 0 N-CA-C 116.446 1.671 . . . . 0.0 116.446 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 5.8 m -45.62 -35.78 4.3 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 126.604 1.962 . . . . 0.0 115.849 -169.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -81.26 -61.98 1.79 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.621 1.1 . . . . 0.0 110.494 174.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.23 168.34 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 125.247 2.451 . . . . 0.0 114.512 -169.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -146.56 148.95 35.52 Favored Pre-proline 0 C--N 1.322 -0.613 0 C-N-CA 129.288 3.035 . . . . 0.0 104.551 -173.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -59.97 -33.63 95.51 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 CA-C-N 121.892 1.712 . . . . 0.0 112.516 -174.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -63.61 -50.45 69.32 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 109.074 -0.714 . . . . 0.0 109.074 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 29.9 t -64.51 -38.61 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 C-N-CA 123.674 0.79 . . . . 0.0 109.086 -178.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -68.07 -40.93 82.6 Favored 'General case' 0 N--CA 1.444 -0.762 0 O-C-N 121.632 -0.667 . . . . 0.0 111.658 -177.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -81.57 -14.48 56.76 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.989 0.813 . . . . 0.0 111.811 -179.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -67.91 -24.67 65.23 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.671 0.789 . . . . 0.0 109.747 169.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 55.6 mt -63.28 148.53 93.09 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 121.604 -0.685 . . . . 0.0 109.546 173.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -55.62 147.87 57.18 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.726 2.284 . . . . 0.0 110.691 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -47.59 -49.71 26.01 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.879 0.872 . . . . 0.0 111.718 -175.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.54 -27.24 66.8 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -177.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 97.0 t -71.66 -36.74 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 118.826 0.739 . . . . 0.0 109.386 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -65.0 -44.83 87.93 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 122.248 1.023 . . . . 0.0 108.493 -178.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.13 -50.74 70.69 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.184 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -65.18 -38.34 90.2 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 122.955 0.502 . . . . 0.0 111.421 -176.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.85 -42.29 95.01 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 119.986 1.266 . . . . 0.0 110.083 177.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.95 -36.5 84.18 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.329 0.513 . . . . 0.0 110.832 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.26 -37.75 71.93 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.379 0.672 . . . . 0.0 111.123 176.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.91 -50.95 62.62 Favored 'General case' 0 CA--C 1.516 -0.343 0 C-N-CA 125.037 1.335 . . . . 0.0 108.65 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -57.51 -48.25 79.76 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 121.561 -0.712 . . . . 0.0 109.151 174.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.6 tpmp? -69.12 -11.0 60.4 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 117.329 -1.319 . . . . 0.0 113.928 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -105.09 6.06 32.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 121.45 1.932 . . . . 0.0 111.839 173.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 34.8 p -125.66 -17.17 5.55 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.028 0.931 . . . . 0.0 111.861 176.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 N-CA-C 106.856 -2.497 . . . . 0.0 106.856 169.991 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo . . . . . 0 CA--C 1.535 0.552 0 N-CA-C 110.846 -0.482 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 16.9 m 46.78 24.79 0.37 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.066 1.347 . . . . 0.0 112.92 -170.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . 0.374 12.2 t0 32.25 41.0 0.02 OUTLIER 'General case' 0 C--O 1.233 0.234 0 C-N-CA 129.537 3.135 . . . . 0.0 116.114 -169.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 4.5 pt -53.13 148.62 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 122.797 1.284 . . . . 0.0 109.343 169.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -70.84 135.9 85.44 Favored Pre-proline 0 N--CA 1.444 -0.729 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 170.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -55.19 -36.69 93.83 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.854 1.703 . . . . 0.0 111.452 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -64.94 -44.5 89.28 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -176.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 51.4 t -69.06 -42.58 82.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -56.56 -45.11 81.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.157 -0.964 . . . . 0.0 113.444 173.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -84.93 -5.75 59.34 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 118.763 0.71 . . . . 0.0 111.587 -174.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -77.04 -22.38 53.05 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.783 1.233 . . . . 0.0 109.252 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 91.3 mt -58.98 150.55 60.44 Favored Pre-proline 0 CA--C 1.534 0.346 0 O-C-N 121.389 -0.82 . . . . 0.0 109.968 175.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -53.49 147.63 37.42 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 123.253 2.635 . . . . 0.0 110.631 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -48.73 -48.59 40.45 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.602 0.761 . . . . 0.0 111.428 -174.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.85 -25.79 63.9 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -178.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 89.3 t -70.9 -43.77 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 119.288 0.949 . . . . 0.0 108.858 172.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -58.52 -47.26 84.73 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.66 0.664 . . . . 0.0 109.314 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.72 -43.26 97.06 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 117.973 -1.013 . . . . 0.0 109.904 -179.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -66.8 -39.14 87.64 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 119.255 0.934 . . . . 0.0 111.038 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -42.87 96.2 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 121.409 -0.807 . . . . 0.0 109.467 176.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 32.2 mt -63.79 -40.97 97.94 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.967 0.803 . . . . 0.0 110.911 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -62.52 -40.92 98.32 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.726 -0.655 . . . . 0.0 110.337 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -60.13 -54.46 45.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 26.9 m0 -66.99 0.23 2.69 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.524 1.13 . . . . 0.0 113.261 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . 0.488 ' HZ1' ' C ' ' A' ' 707' ' ' GLY . 1.2 tppm? -125.55 10.91 7.91 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.786 -1.196 . . . . 0.0 113.63 169.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -117.99 13.91 14.03 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.714 1.206 . . . . 0.0 110.542 169.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 24.7 p -131.92 -7.41 3.52 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.148 1.779 . . . . 0.0 111.518 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . 0.488 ' C ' ' HZ1' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.253 1.289 0 N-CA-C 104.665 -3.374 . . . . 0.0 104.665 -169.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo . . . . . 0 CA--C 1.542 0.894 0 CA-C-O 121.664 0.61 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 14.4 m -148.58 17.73 1.03 Allowed 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.413 -1.429 . . . . 0.0 111.736 176.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -87.71 -38.66 15.63 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.375 1.47 . . . . 0.0 109.219 169.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 12.9 pt -83.9 145.26 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 C-N-CA 124.845 1.258 . . . . 0.0 110.669 170.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -84.3 142.59 40.92 Favored Pre-proline 0 CA--C 1.541 0.632 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 168.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -74.77 -29.0 9.13 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 CA-C-N 120.286 1.138 . . . . 0.0 111.064 -171.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -69.14 -43.76 73.71 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 119.481 1.037 . . . . 0.0 109.09 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 92.2 t -56.58 -44.82 81.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 174.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . 0.409 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 90.7 t80 -59.58 -43.14 93.72 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 175.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -78.13 -13.08 60.0 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.761 1.164 . . . . 0.0 112.367 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -82.09 -7.01 59.6 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.019 0.928 . . . . 0.0 110.933 168.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 71.8 mt -65.61 152.91 91.75 Favored Pre-proline 0 CA--C 1.534 0.354 0 O-C-N 121.036 -1.04 . . . . 0.0 109.083 169.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -55.2 145.99 62.5 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.074 2.516 . . . . 0.0 110.511 178.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 32.3 tp10 -46.21 -50.18 16.16 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.267 1.027 . . . . 0.0 112.09 -174.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.88 -29.47 67.77 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -177.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 94.2 t -68.04 -41.34 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.409 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.3 mt-30 -63.31 -46.68 85.55 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 -177.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -40.9 85.74 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 117.393 -1.289 . . . . 0.0 110.57 -175.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . 0.41 ' CD ' HH22 ' A' ' 705' ' ' ARG . 19.4 tp10 -69.8 -43.69 71.56 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 119.921 1.237 . . . . 0.0 111.146 179.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.76 -42.87 99.55 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 121.132 -0.98 . . . . 0.0 111.041 177.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 27.5 mt -64.69 -39.52 93.81 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.394 0.543 . . . . 0.0 110.696 176.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -56.38 -55.97 26.94 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-O 115.968 -1.968 . . . . 0.0 108.537 170.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -49.32 -49.16 45.22 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 122.558 2.436 . . . . 0.0 110.122 175.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -70.56 -4.51 23.4 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -175.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 1.7 tppm? -135.67 -5.97 2.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 121.148 1.795 . . . . 0.0 115.029 169.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . 0.41 HH22 ' CD ' ' A' ' 698' ' ' GLU . 29.7 ttm180 -77.19 -37.51 53.42 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 127.184 2.194 . . . . 0.0 109.095 170.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.52 61.34 0.72 Allowed 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 -168.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.039 0 N-CA-C 109.364 -1.494 . . . . 0.0 109.364 -169.619 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo . . . . . 0 N--CA 1.46 -0.468 0 CA-C-O 118.407 -0.747 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 19.3 m 116.93 16.57 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 131.528 3.931 . . . . 0.0 110.39 -178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -114.97 -37.94 4.03 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.761 1.624 . . . . 0.0 112.808 -169.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.3 pt -92.1 138.65 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.723 1.209 . . . . 0.0 111.617 -173.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -65.69 138.75 96.77 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 168.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.61 -28.12 10.2 Favored 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 121.278 1.319 . . . . 0.0 111.165 -169.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 23.6 mm100 -69.1 -46.77 66.91 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 119.484 1.038 . . . . 0.0 108.436 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 89.3 t -57.99 -36.03 54.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.339 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -68.89 -53.04 23.4 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 119.363 0.983 . . . . 0.0 113.608 169.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -75.87 -10.64 59.6 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.968 -1.082 . . . . 0.0 112.954 -169.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -83.91 -1.87 55.37 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.808 1.243 . . . . 0.0 111.196 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 58.7 mt -70.59 156.65 91.63 Favored Pre-proline 0 CA--C 1.535 0.397 0 O-C-N 120.859 -1.151 . . . . 0.0 109.415 169.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -56.33 142.77 87.92 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.251 2.634 . . . . 0.0 110.696 177.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.02 -36.06 67.54 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.688 0.795 . . . . 0.0 112.948 -172.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.96 -33.27 70.29 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.297 -0.877 . . . . 0.0 113.093 175.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 75.5 t -65.11 -43.34 95.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 173.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -56.48 -53.12 61.21 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -53.45 -41.36 66.06 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 118.089 -0.958 . . . . 0.0 113.03 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -42.31 84.37 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.75 0.705 . . . . 0.0 110.193 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -66.08 -36.21 82.59 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 120.999 -1.063 . . . . 0.0 112.569 174.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.56 -44.51 96.08 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.711 1.141 . . . . 0.0 108.753 172.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.99 96.55 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.511 177.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.13 -46.17 90.54 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 119.937 1.244 . . . . 0.0 110.437 177.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 38.9 m0 -64.72 -14.1 57.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 120.653 -1.28 . . . . 0.0 112.099 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 704' ' ' LYS . . . . . 0.458 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.5 OUTLIER -103.64 -17.33 15.19 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 117.749 -1.119 . . . . 0.0 112.51 168.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 80.7 mtm-85 -69.72 -40.68 76.09 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 121.41 1.914 . . . . 0.0 109.244 169.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 20.7 p -77.21 29.79 0.14 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.075 1.75 . . . . 0.0 113.244 -169.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 707' ' ' GLY . . . . . 0.429 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.242 0.642 0 N-CA-C 108.763 -1.735 . . . . 0.0 108.763 -170.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.527 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -147.55 146.42 29.43 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 12.7 ptm 46.09 17.91 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.708 2.003 . . . . 0.0 114.709 -169.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -152.35 152.56 29.45 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 128.337 2.655 . . . . 0.0 105.641 -174.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.264 0.0 OUTLIER -11.46 -88.07 0.0 OUTLIER 'Trans proline' 0 C--N 1.351 0.706 1 C-N-CA 127.347 5.364 . . . . 0.0 118.91 -176.584 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 67.6 m -160.17 -40.27 0.05 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.751 1.159 . . . . 0.0 110.815 177.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . 0.455 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 17.1 p-10 -77.55 -63.09 1.46 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.318 1.447 . . . . 0.0 109.343 176.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . 0.455 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 1.4 pt -61.71 116.91 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 C-N-CA 125.49 1.516 . . . . 0.0 110.728 -172.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.53 157.83 63.97 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 168.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -56.72 -42.56 63.69 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.573 2.182 . . . . 0.0 111.093 -169.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -63.86 -43.53 95.81 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 123.728 0.642 . . . . 0.0 110.003 -176.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 15.6 t -65.94 -36.89 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.752 0.821 . . . . 0.0 109.785 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -64.37 -37.9 89.13 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.429 -0.794 . . . . 0.0 111.19 174.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -81.47 -14.38 57.08 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 118.933 0.788 . . . . 0.0 112.658 -178.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -73.63 -16.16 61.24 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.991 1.317 . . . . 0.0 110.723 169.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 81.1 mt -66.97 150.82 97.67 Favored Pre-proline 0 CA--C 1.533 0.306 0 O-C-N 121.521 -0.737 . . . . 0.0 109.186 171.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -54.97 142.46 76.16 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.372 2.048 . . . . 0.0 110.33 173.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.89 -35.68 61.87 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.984 0.914 . . . . 0.0 112.178 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -72.47 -28.66 63.05 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 61.2 t -70.68 -37.46 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 172.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -62.26 -50.37 72.01 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -176.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -49.18 -48.24 45.31 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.79 1.236 . . . . 0.0 113.363 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -41.74 96.33 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 118.527 0.603 . . . . 0.0 110.412 -179.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.98 -32.52 73.88 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.151 -0.968 . . . . 0.0 111.948 175.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.34 -40.35 97.05 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 119.734 1.152 . . . . 0.0 109.885 171.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.12 -34.32 70.95 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.257 176.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.39 -51.71 61.84 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 124.377 1.071 . . . . 0.0 109.598 176.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 21.2 m0 -59.94 -46.31 89.81 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 175.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.6 tptp -69.16 -11.35 60.72 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 120.357 1.435 . . . . 0.0 113.771 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -104.14 5.0 34.73 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 121.417 1.917 . . . . 0.0 111.821 172.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 29.5 p -124.42 -14.96 6.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.56 0.744 . . . . 0.0 112.202 174.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 N-CA-C 106.9 -2.48 . . . . 0.0 106.9 170.352 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.251 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -66.76 143.41 56.94 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 118.473 1.136 . . . . 0.0 110.336 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 12.6 ttp 54.88 8.46 0.23 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.067 2.147 . . . . 0.0 116.492 169.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -149.08 173.48 4.19 Favored Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 125.659 1.584 . . . . 0.0 107.171 -170.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -43.5 157.86 0.11 Allowed 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 122.491 2.127 . . . . 0.0 113.613 168.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 2.3 m -48.82 -37.84 20.47 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.446 1.498 . . . . 0.0 114.331 -169.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . 0.435 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 17.1 p-10 -79.75 -70.34 0.52 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.503 1.521 . . . . 0.0 110.887 -179.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . 0.435 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 1.5 pt -62.04 117.25 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 C-N-CA 125.739 1.615 . . . . 0.0 110.846 -170.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.14 160.43 62.9 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 169.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -58.96 -38.29 88.88 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.419 2.079 . . . . 0.0 111.563 -174.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -56.92 -54.62 44.49 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 124.011 0.819 . . . . 0.0 110.019 175.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 11.2 t -65.33 -33.59 64.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 C-N-CA 123.015 0.526 . . . . 0.0 109.618 -174.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 75.7 t80 -68.44 -39.42 81.53 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.985 -0.447 . . . . 0.0 112.139 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -84.34 -16.94 41.12 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.904 0.774 . . . . 0.0 111.653 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -71.81 -13.93 61.83 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.687 1.195 . . . . 0.0 110.41 169.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.02 151.97 96.55 Favored Pre-proline 0 CA--C 1.536 0.408 0 O-C-N 121.436 -0.79 . . . . 0.0 109.349 169.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -55.03 144.12 70.24 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.421 2.08 . . . . 0.0 110.091 175.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . 0.45 ' CD ' ' HZ2' ' A' ' 697' ' ' LYS . 46.2 tp10 -30.87 -63.84 0.14 Allowed 'General case' 0 C--O 1.232 0.146 0 C-N-CA 126.922 2.089 . . . . 0.0 111.328 175.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.58 -23.94 64.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -172.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 80.6 t -69.48 -36.25 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 119.17 0.895 . . . . 0.0 109.374 173.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.417 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 59.6 mt-30 -65.93 -46.32 78.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . 0.45 ' HZ2' ' CD ' ' A' ' 693' ' ' GLU . 12.4 mptt -67.83 -41.92 82.27 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 114.381 -1.281 . . . . 0.0 109.325 -175.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -65.63 -41.36 92.75 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 119.094 -0.479 . . . . 0.0 110.884 176.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -36.29 83.9 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 119.563 1.074 . . . . 0.0 110.696 177.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 44.6 mt -67.42 -41.54 84.68 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.835 0.743 . . . . 0.0 110.204 174.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.46 -37.13 86.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.281 0.491 . . . . 0.0 110.672 173.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -63.88 -55.19 24.59 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.654 1.182 . . . . 0.0 108.315 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -65.85 -7.84 18.59 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.329 -0.857 . . . . 0.0 112.877 175.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . 0.477 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -107.74 2.5 23.74 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.324 169.915 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -119.34 -2.72 10.57 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.667 1.187 . . . . 0.0 112.364 169.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.9 p -115.84 -7.35 12.05 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.48 1.512 . . . . 0.0 110.962 173.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . 0.451 ' C ' ' HZ3' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.246 0.882 0 C-N-CA 130.217 3.77 . . . . 0.0 104.072 169.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . 0.436 ' H3 ' ' CG ' ' A' ' 682' ' ' ASP . . . . . . . . 0 N--CA 1.465 0.581 0 N-CA-C 109.671 -1.371 . . . . 0.0 109.671 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -149.04 117.53 6.53 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 26.6 ptt? 41.47 42.57 1.95 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.495 1.918 . . . . 0.0 115.616 169.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -139.35 160.42 62.01 Favored Pre-proline 0 CA--C 1.536 0.442 0 O-C-N 121.439 -0.788 . . . . 0.0 109.156 -176.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo -40.65 149.7 0.15 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 124.502 3.468 . . . . 0.0 113.091 168.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 11.2 m 46.99 26.39 0.59 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.481 1.512 . . . . 0.0 114.779 169.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . 0.436 ' CG ' ' H3 ' ' A' ' -3' ' ' GLY 0.267 23.5 t0 51.99 32.63 10.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.719 2.008 . . . . 0.0 114.471 -174.126 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 22.9 mt -70.52 173.61 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 168.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.41 147.47 37.1 Favored Pre-proline 0 C--N 1.321 -0.646 0 N-CA-C 105.836 -1.912 . . . . 0.0 105.836 169.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -65.33 -34.91 42.61 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 CA-C-N 120.775 1.313 . . . . 0.0 111.549 -169.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -65.61 -48.65 71.54 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 176.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 49.4 t -55.05 -33.71 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 123.5 0.72 . . . . 0.0 110.224 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.42 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 65.6 t80 -75.52 -47.99 24.5 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 178.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -78.56 -11.95 59.99 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.032 -1.043 . . . . 0.0 111.728 -175.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -70.53 -20.47 62.81 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.085 1.354 . . . . 0.0 109.751 168.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 73.3 mt -65.6 151.52 94.41 Favored Pre-proline 0 CA--C 1.533 0.297 0 O-C-N 121.393 -0.817 . . . . 0.0 109.47 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_exo -54.39 146.88 49.37 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.222 2.615 . . . . 0.0 110.031 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.3 tp10 -47.63 -49.5 26.98 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.553 0.741 . . . . 0.0 112.021 -173.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -66.78 -30.45 70.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 93.3 t -68.14 -39.3 81.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 175.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.42 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 73.6 mt-30 -64.07 -45.13 90.14 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 122.315 1.055 . . . . 0.0 108.214 -178.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.08 -52.42 65.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.42 -1.263 . . . . 0.0 109.917 -178.804 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -64.64 -36.74 85.23 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 118.941 0.791 . . . . 0.0 111.599 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -38.61 86.18 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.018 0.826 . . . . 0.0 110.33 177.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 31.0 mt -68.49 -38.07 80.66 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 119.546 1.066 . . . . 0.0 110.42 174.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.49 -38.84 92.69 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.685 0.675 . . . . 0.0 110.242 173.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.27 -55.33 33.18 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 124.164 0.985 . . . . 0.0 108.775 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -67.16 -6.22 16.88 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.088 -1.007 . . . . 0.0 112.841 177.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -110.3 3.01 19.5 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.402 1.001 . . . . 0.0 112.903 170.321 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -117.96 -9.55 10.57 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.528 1.131 . . . . 0.0 112.319 169.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.5 p -108.87 -5.68 16.09 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.465 1.506 . . . . 0.0 111.518 173.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . 0.469 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.252 1.271 0 N-CA-C 104.32 -3.512 . . . . 0.0 104.32 169.461 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.523 0 N-CA-C 107.263 -2.335 . . . . 0.0 107.263 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . 0.426 ' CG ' ' H ' ' A' ' -1' ' ' MET . 43.6 t60 62.39 169.17 0.13 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.65 1.58 . . . . 0.0 110.182 -168.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' MET . . . . . 0.426 ' H ' ' CG ' ' A' ' -2' ' ' HIS . 7.3 tpt -49.67 -30.65 9.47 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 126.851 2.06 . . . . 0.0 115.392 -169.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -155.68 127.78 3.94 Favored Pre-proline 0 CA--C 1.538 0.492 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 169.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -66.29 -152.96 0.02 OUTLIER 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 125.285 3.99 . . . . 0.0 112.243 168.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 12.9 m -145.64 9.0 1.17 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.191 -1.568 . . . . 0.0 112.942 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -77.37 -0.65 26.5 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.704 1.602 . . . . 0.0 111.933 169.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 8.8 pt -145.05 163.14 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 C-N-CA 127.436 2.294 . . . . 0.0 108.479 -172.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.75 150.42 37.71 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 125.331 1.452 . . . . 0.0 107.207 170.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -66.53 -37.48 22.38 Favored 'Trans proline' 0 N--CA 1.452 -0.957 0 C-N-CA 123.0 2.466 . . . . 0.0 113.413 -173.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 19.5 mm100 -68.25 -46.66 69.87 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 86.1 t -56.37 -40.51 67.26 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -64.26 -52.71 57.34 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 173.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -69.33 -26.13 64.55 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.572 1.078 . . . . 0.0 111.569 -171.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -71.13 -7.82 49.24 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.818 1.647 . . . . 0.0 112.461 171.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 51.6 mt -65.07 153.83 88.16 Favored Pre-proline 0 CA--C 1.537 0.47 0 O-C-N 120.746 -1.221 . . . . 0.0 109.62 169.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -53.63 142.45 60.73 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.405 2.737 . . . . 0.0 109.851 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -48.75 -41.51 32.41 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 123.683 0.793 . . . . 0.0 112.786 -172.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -73.65 -31.69 63.62 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 72.8 t -66.2 -48.17 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 170.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -55.03 -43.56 73.83 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 123.854 0.862 . . . . 0.0 110.919 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.41 -45.41 91.11 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 117.537 -1.22 . . . . 0.0 110.459 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -71.02 -39.92 72.06 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.742 1.156 . . . . 0.0 111.342 -177.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.36 -44.97 89.76 Favored 'General case' 0 C--O 1.226 -0.163 0 O-C-N 121.47 -0.769 . . . . 0.0 110.974 175.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 61.3 mt -58.15 -39.86 79.88 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 119.147 0.885 . . . . 0.0 109.821 173.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -64.92 -44.67 88.77 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 117.412 -1.28 . . . . 0.0 111.089 178.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.98 -50.48 64.04 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.639 1.563 . . . . 0.0 108.825 172.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 49.6 m0 -68.23 -9.04 44.29 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.026 1.33 . . . . 0.0 113.532 -177.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -110.31 -3.36 16.25 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.734 0.814 . . . . 0.0 112.182 169.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -91.32 -6.61 52.81 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.208 0.913 . . . . 0.0 109.509 168.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 54.4 p -131.08 4.63 4.44 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 114.131 1.159 . . . . 0.0 114.131 -169.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 N-CA-C 106.312 -2.715 . . . . 0.0 106.312 -176.052 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.645 0 CA-C-O 119.687 -0.507 . . . . 0.0 113.236 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 55.6 m80 -125.45 -21.92 4.42 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.354 1.462 . . . . 0.0 110.201 169.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 28.4 ttt -135.64 3.16 2.99 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.787 1.635 . . . . 0.0 110.903 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -140.9 175.66 2.95 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 127.184 2.193 . . . . 0.0 106.632 174.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -39.84 156.2 0.04 OUTLIER 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 123.476 2.784 . . . . 0.0 114.906 169.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.7 m -40.6 -39.33 1.03 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.651 1.98 . . . . 0.0 116.32 -169.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 16.4 p-10 -82.27 -69.05 0.65 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.972 1.309 . . . . 0.0 110.517 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.5 pt -62.38 160.46 2.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 125.807 1.643 . . . . 0.0 112.577 -172.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.57 166.48 20.66 Favored Pre-proline 0 N--CA 1.464 0.257 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 169.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -54.81 -37.99 92.24 Favored 'Trans proline' 0 CA--C 1.505 -0.973 0 C-N-CA 122.553 2.169 . . . . 0.0 113.725 -168.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -61.6 -54.84 37.58 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 13.9 t -65.89 -34.18 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 124.471 1.108 . . . . 0.0 109.811 -173.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.42 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 66.6 t80 -72.31 -37.4 68.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 122.906 0.482 . . . . 0.0 111.848 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -83.07 -16.86 45.28 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.547 0.612 . . . . 0.0 111.301 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -71.56 -12.55 61.42 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.544 1.138 . . . . 0.0 110.872 169.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 69.7 mt -73.61 152.44 89.5 Favored Pre-proline 0 CA--C 1.539 0.538 0 O-C-N 121.313 -0.867 . . . . 0.0 109.766 174.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -56.47 155.64 24.92 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 123.194 2.596 . . . . 0.0 111.528 172.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -42.07 46.9 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.527 0.731 . . . . 0.0 110.81 176.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -62.11 -53.46 55.16 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 -176.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 41.3 t -60.15 -32.47 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.476 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.42 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.9 mt-30 -68.84 -55.9 9.69 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 120.071 1.305 . . . . 0.0 108.606 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . 0.335 0.0 OUTLIER -74.24 -30.79 62.32 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.248 -169.404 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -68.23 -39.97 82.15 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 119.671 1.123 . . . . 0.0 109.101 170.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -36.94 85.72 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.561 1.073 . . . . 0.0 110.116 174.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 15.1 mt -62.47 -42.26 99.36 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 119.114 0.87 . . . . 0.0 110.143 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.0 -42.17 81.15 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.869 0.759 . . . . 0.0 110.827 178.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -59.26 -53.19 61.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.142 1.377 . . . . 0.0 109.454 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -66.88 -32.15 73.22 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 118.408 -0.806 . . . . 0.0 110.923 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . 0.467 ' HZ2' ' C ' ' A' ' 707' ' ' GLY . 0.2 OUTLIER -60.72 -25.94 66.81 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 119.566 1.075 . . . . 0.0 111.829 174.254 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -64.44 -12.39 43.01 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.963 1.256 . . . . 0.0 113.543 170.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 1.9 p -130.17 -17.36 3.45 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -169.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . 0.467 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.247 0.934 0 N-CA-C 105.903 -2.879 . . . . 0.0 105.903 176.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . 0.405 ' HA2' ' O ' ' A' ' 683' ' ' ILE . . . . . . . . 0 N--CA 1.47 0.942 0 N-CA-C 114.828 0.691 . . . . 0.0 114.828 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -35.99 75.9 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 118.31 1.055 . . . . 0.0 111.742 169.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 8.5 ptm -148.56 35.08 0.78 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.311 1.044 . . . . 0.0 110.171 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . 0.414 ' CZ ' ' CD2' ' A' ' 688' ' ' PHE . 5.7 m-85 -150.3 171.76 6.03 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 127.069 2.148 . . . . 0.0 106.402 -173.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -40.34 145.59 0.33 Allowed 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.615 2.21 . . . . 0.0 112.288 168.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 2.2 m -45.96 -39.34 8.8 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 114.781 1.401 . . . . 0.0 114.781 -168.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . 0.477 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 11.7 p-10 -66.15 -85.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.885 2.074 . . . . 0.0 111.021 173.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . 0.477 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 4.0 pt -55.16 118.21 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 C-N-CA 125.533 1.533 . . . . 0.0 110.107 -169.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.6 152.78 67.34 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 170.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -57.38 -37.17 98.32 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.163 2.575 . . . . 0.0 111.771 -169.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -56.41 -55.37 34.37 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 5.2 t -60.82 -37.28 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 C-N-CA 124.532 1.133 . . . . 0.0 109.607 -176.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.462 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 72.0 t80 -69.61 -40.76 76.43 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 119.068 -0.491 . . . . 0.0 112.029 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -77.0 -20.29 56.23 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.456 1.026 . . . . 0.0 111.281 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -70.52 -11.22 60.79 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.282 1.033 . . . . 0.0 111.524 169.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 83.1 mt -70.59 152.32 95.34 Favored Pre-proline 0 CA--C 1.535 0.379 0 O-C-N 121.057 -1.027 . . . . 0.0 109.139 169.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -53.98 147.34 43.25 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.464 2.109 . . . . 0.0 110.162 175.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . 0.468 ' CD ' ' HZ3' ' A' ' 697' ' ' LYS . 41.0 tp10 -40.95 -57.51 1.97 Allowed 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.069 1.348 . . . . 0.0 111.05 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.01 -25.04 63.4 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -173.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 78.9 t -67.31 -45.14 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.462 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 62.9 mt-30 -55.53 -43.24 75.59 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.249 0.547 . . . . 0.0 109.645 178.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . 0.468 ' HZ3' ' CD ' ' A' ' 693' ' ' GLU . 11.7 mptt -74.21 -40.75 62.25 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.218 -173.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -62.99 -40.08 96.7 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 119.219 0.918 . . . . 0.0 110.862 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.3 -38.61 91.65 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 119.468 1.031 . . . . 0.0 111.272 177.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.19 -44.38 84.15 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.923 0.783 . . . . 0.0 110.116 174.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.13 82.9 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 119.148 -0.453 . . . . 0.0 110.58 174.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.75 -54.83 33.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.463 1.105 . . . . 0.0 108.113 178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 22.1 m0 -65.73 -2.84 4.0 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.285 1.034 . . . . 0.0 113.045 176.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -117.13 5.06 12.71 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.861 1.209 . . . . 0.0 113.759 169.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 19.1 ptt180 -117.93 9.46 12.84 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.638 1.175 . . . . 0.0 111.461 169.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 28.8 p -125.9 -3.56 7.06 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.206 1.402 . . . . 0.0 111.884 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.577 0 N-CA-C 105.388 -3.085 . . . . 0.0 105.388 -172.645 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.493 0 N-CA-C 107.264 -2.334 . . . . 0.0 107.264 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -67.93 -21.88 65.09 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.019 0.91 . . . . 0.0 110.817 169.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 24.3 ttt -152.69 159.24 43.17 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 127.108 2.163 . . . . 0.0 105.359 173.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 64.39 164.43 0.12 Allowed Pre-proline 0 CA--C 1.552 1.047 0 CA-C-N 120.271 1.396 . . . . 0.0 110.385 -168.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -43.59 156.61 0.15 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.731 2.954 . . . . 0.0 114.826 169.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 4.2 m -60.67 -30.3 69.83 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.418 1.087 . . . . 0.0 113.539 -172.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -69.06 -9.94 55.07 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.848 2.459 . . . . 0.0 114.111 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 13.1 pt -145.82 -178.24 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 125.549 1.54 . . . . 0.0 108.323 -174.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -152.03 162.75 25.73 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 168.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -57.51 -36.71 98.65 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.213 1.942 . . . . 0.0 113.577 -168.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -62.37 -53.46 54.71 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -177.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 4.1 t -68.73 -33.19 58.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.748 -173.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.45 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 66.6 t80 -65.73 -39.39 91.09 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 118.391 0.541 . . . . 0.0 111.161 177.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -81.4 -16.6 51.67 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.68 -0.638 . . . . 0.0 111.551 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -75.18 -13.22 60.44 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.168 0.894 . . . . 0.0 110.832 169.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 64.6 mt -68.84 152.32 96.82 Favored Pre-proline 0 C--N 1.344 0.357 0 O-C-N 121.075 -1.016 . . . . 0.0 109.216 170.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -53.65 144.74 51.74 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.382 2.055 . . . . 0.0 110.745 173.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.05 -34.35 65.82 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.598 0.759 . . . . 0.0 112.791 -176.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.5 -38.78 74.38 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.701 -0.624 . . . . 0.0 112.49 173.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 96.2 t -61.53 -37.11 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 O-C-N 120.88 -1.137 . . . . 0.0 109.559 175.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.45 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 68.5 mt-30 -58.52 -53.93 52.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -51.75 -52.44 48.65 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.19 -36.14 79.11 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -171.077 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.03 -38.67 89.59 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.495 171.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.75 -38.35 87.66 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-N 119.425 1.012 . . . . 0.0 110.343 173.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.47 72.67 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.561 0.619 . . . . 0.0 110.901 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -60.44 -52.28 65.9 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 176.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.4 m0 -58.61 -46.1 87.75 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 118.531 -0.747 . . . . 0.0 110.06 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -68.13 -19.56 64.83 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 120.405 1.457 . . . . 0.0 112.643 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -84.87 -4.68 59.2 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 120.692 1.587 . . . . 0.0 113.083 169.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 37.5 p -126.3 -15.26 5.74 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.165 1.348 . . . . 0.0 112.325 -171.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.975 0 N-CA-C 106.282 -2.727 . . . . 0.0 106.282 169.869 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.226 0 N-CA-C 108.342 -1.903 . . . . 0.0 108.342 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 17.3 p80 -87.84 -15.4 36.92 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.44 1.096 . . . . 0.0 112.999 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 28.4 ttt -149.29 -33.77 0.2 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 120.195 1.361 . . . . 0.0 113.787 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -100.38 175.75 2.24 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-O 118.496 -0.764 . . . . 0.0 108.953 170.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo -42.77 161.31 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.719 2.946 . . . . 0.0 114.869 169.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 5.0 m -55.55 -27.37 48.59 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.173 1.545 . . . . 0.0 115.173 -169.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -91.03 -7.78 50.91 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.615 1.966 . . . . 0.0 113.512 -172.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.3 pt -140.05 170.27 15.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 125.72 1.608 . . . . 0.0 108.569 -174.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -151.82 170.04 8.53 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 168.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -54.58 -37.12 90.64 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.056 1.837 . . . . 0.0 113.062 -168.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -61.6 -55.73 27.58 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.47 -36.51 76.54 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 C-N-CA 124.833 1.253 . . . . 0.0 109.93 -172.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -73.49 -37.58 65.68 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.836 -0.54 . . . . 0.0 111.315 -178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -81.36 -16.17 53.09 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.805 -0.559 . . . . 0.0 110.936 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -73.3 -13.43 61.12 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.343 1.057 . . . . 0.0 110.762 169.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 69.2 mt -73.72 152.86 89.34 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.142 -0.974 . . . . 0.0 109.108 172.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -54.69 142.54 72.75 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.076 1.851 . . . . 0.0 110.611 172.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.63 -33.91 64.45 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.583 0.753 . . . . 0.0 112.098 -179.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -72.45 -30.51 64.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.341 -0.849 . . . . 0.0 113.205 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 64.4 t -69.0 -42.44 82.11 Favored 'Isoleucine or valine' 0 C--O 1.23 0.051 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 172.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -54.82 -49.87 69.97 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -54.39 -46.98 73.19 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 175.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.62 -40.25 95.15 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.625 0.648 . . . . 0.0 110.499 -177.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.86 -32.65 73.93 Favored 'General case' 0 C--N 1.332 -0.152 0 C-N-CA 124.224 1.01 . . . . 0.0 111.375 175.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 18.8 mt -65.7 -41.54 92.24 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 120.066 1.303 . . . . 0.0 110.261 170.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.78 -38.35 90.76 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.45 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -59.58 -55.3 36.25 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 119.103 0.865 . . . . 0.0 109.43 173.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -71.62 4.87 2.77 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.214 -0.929 . . . . 0.0 112.638 177.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . 0.488 ' HZ2' ' C ' ' A' ' 707' ' ' GLY 0.266 1.2 tppm? -124.4 10.79 8.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.588 1.155 . . . . 0.0 112.617 169.064 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -122.51 4.99 9.59 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.815 1.246 . . . . 0.0 110.98 168.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 32.5 p -121.6 -6.91 9.17 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.453 1.501 . . . . 0.0 111.656 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . 0.488 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.245 0.831 0 N-CA-C 105.531 -3.028 . . . . 0.0 105.531 -176.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.331 0 N-CA-C 107.915 -2.074 . . . . 0.0 107.915 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . 0.64 ' CG ' ' H ' ' A' ' -1' ' ' MET . 25.4 t-80 62.97 -172.32 0.16 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.914 1.286 . . . . 0.0 110.685 -171.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' MET . . . . . 0.64 ' H ' ' CG ' ' A' ' -2' ' ' HIS . 13.3 tpt -105.03 -23.48 12.94 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.353 1.061 . . . . 0.0 111.706 -172.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -152.78 154.1 30.94 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 123.992 0.917 . . . . 0.0 109.985 172.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -68.53 -157.8 0.04 OUTLIER 'Trans proline' 0 CA--C 1.546 1.101 1 C-N-CA 125.885 4.39 . . . . 0.0 111.636 168.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 70.3 p -135.38 49.24 2.19 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.589 1.156 . . . . 0.0 109.248 -176.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.4 -58.39 0.13 Allowed 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.396 1.078 . . . . 0.0 109.383 -169.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 12.8 pt -69.93 128.97 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 123.565 0.746 . . . . 0.0 109.025 169.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -73.83 139.62 77.13 Favored Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 168.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.83 -37.09 97.66 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.698 2.266 . . . . 0.0 112.017 -174.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -68.88 -41.19 78.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.069 -0.491 . . . . 0.0 109.68 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 99.7 t -62.41 -40.74 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.462 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 84.5 t80 -62.45 -40.17 95.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 121.344 -0.847 . . . . 0.0 112.376 173.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -76.91 -10.86 59.65 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.488 -0.758 . . . . 0.0 111.998 -178.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -72.98 -21.27 60.87 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.502 1.047 . . . . 0.0 110.3 168.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 83.7 mt -61.25 151.16 77.24 Favored Pre-proline 0 CA--C 1.536 0.409 0 O-C-N 121.092 -1.005 . . . . 0.0 109.658 175.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -54.06 148.05 41.09 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 123.12 2.547 . . . . 0.0 110.981 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . 0.418 ' CD ' ' HZ1' ' A' ' 697' ' ' LYS . 48.3 tp10 -34.06 -62.89 0.3 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 126.367 1.867 . . . . 0.0 111.331 176.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.48 -27.45 64.22 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -172.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 72.7 t -64.97 -45.62 94.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 174.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.462 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 60.1 mt-30 -56.84 -49.59 74.98 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . 0.418 ' HZ1' ' CD ' ' A' ' 693' ' ' GLU . 12.9 mptt -67.21 -33.04 74.52 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 116.93 -1.51 . . . . 0.0 111.893 -169.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -67.1 -50.5 61.38 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.244 1.384 . . . . 0.0 109.706 172.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -59.0 -38.74 79.9 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.396 0.998 . . . . 0.0 111.652 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 45.5 mt -67.99 -43.49 78.79 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.719 0.808 . . . . 0.0 109.994 176.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.25 -28.47 66.34 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.635 -0.698 . . . . 0.0 111.515 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -66.87 -61.35 2.0 Allowed 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 170.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.3 m0 -57.89 -20.55 37.66 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 117.339 -1.315 . . . . 0.0 112.071 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 4.2 mmpm? -89.28 -34.22 16.67 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 122.252 2.296 . . . . 0.0 112.794 169.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 7.5 ptp85 -65.64 -19.86 66.08 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 120.871 1.669 . . . . 0.0 110.744 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 24.3 p -106.38 21.33 17.58 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.788 1.235 . . . . 0.0 111.982 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 CA-C-O 118.358 -1.246 . . . . 0.0 110.258 175.023 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.564 0 CA-C-O 118.46 -1.189 . . . . 0.0 110.679 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -139.32 -15.91 1.08 Allowed 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.201 1.501 . . . . 0.0 114.521 -169.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 74.8 mtp -125.34 9.84 7.93 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.622 1.555 . . . . 0.0 112.431 -169.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -149.74 164.22 21.69 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 128.636 2.774 . . . . 0.0 104.409 169.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.271 0.0 OUTLIER -13.07 -75.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.805 1 C-N-CA 126.567 4.845 . . . . 0.0 119.669 -169.872 . . . . . . . . 4 3 . 1 . 010 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 59.1 m -160.91 -41.67 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 120.071 1.305 . . . . 0.0 110.463 172.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 19.2 p-10 -81.15 -61.54 1.92 Allowed 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.946 1.698 . . . . 0.0 109.217 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 3.4 pt -62.33 156.66 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 125.249 1.419 . . . . 0.0 111.605 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -137.94 165.85 30.56 Favored Pre-proline 0 C--N 1.329 -0.298 0 C-N-CA 126.803 2.041 . . . . 0.0 105.898 172.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -58.33 -36.32 97.76 Favored 'Trans proline' 0 CA--C 1.508 -0.775 0 C-N-CA 123.089 2.526 . . . . 0.0 113.795 -168.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -62.36 -54.7 36.55 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 17.8 t -60.08 -39.47 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.073 0 C-N-CA 124.981 1.312 . . . . 0.0 109.25 -174.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.421 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 68.7 t80 -70.52 -39.32 74.14 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.808 -177.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -82.84 -16.23 48.49 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.032 0.833 . . . . 0.0 111.234 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -71.24 -11.66 61.04 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.529 1.131 . . . . 0.0 110.656 168.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 53.6 mt -76.5 152.4 83.41 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 124.027 0.931 . . . . 0.0 109.284 171.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -56.2 146.99 68.44 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.944 2.429 . . . . 0.0 110.947 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -46.76 -49.91 18.99 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.075 0.95 . . . . 0.0 112.003 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.55 -28.28 67.66 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -177.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 81.8 t -69.48 -36.93 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 CA-C-N 118.747 0.703 . . . . 0.0 109.493 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.421 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 70.7 mt-30 -65.38 -46.45 80.05 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.231 1.015 . . . . 0.0 108.365 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -50.26 74.54 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.607 178.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.82 -39.52 90.94 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 123.32 0.648 . . . . 0.0 111.515 -175.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -40.81 95.67 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 121.283 -0.885 . . . . 0.0 109.81 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 40.3 mt -65.36 -41.14 94.12 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.085 0.857 . . . . 0.0 110.409 174.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.74 -40.7 93.4 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.963 -0.542 . . . . 0.0 110.446 175.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.28 -54.86 38.64 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.014 0.925 . . . . 0.0 108.824 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -67.46 0.8 2.7 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.347 1.059 . . . . 0.0 113.066 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . 0.467 ' HZ3' ' C ' ' A' ' 707' ' ' GLY . 0.3 OUTLIER -122.14 7.16 9.71 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.425 1.011 . . . . 0.0 113.19 169.385 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -118.4 13.28 13.54 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.563 1.145 . . . . 0.0 111.52 170.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 23.3 p -129.92 -7.12 4.46 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.235 1.414 . . . . 0.0 111.958 -176.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . 0.467 ' C ' ' HZ3' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.247 0.947 0 N-CA-C 104.332 -3.507 . . . . 0.0 104.332 -169.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.012 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 14.1 m170 73.52 -53.26 0.7 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 127.263 2.225 . . . . 0.0 113.623 171.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 18.1 ptm -151.21 17.47 0.75 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.121 0.969 . . . . 0.0 110.767 169.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . 0.414 ' CZ ' ' CD2' ' A' ' 688' ' ' PHE . 11.8 m-85 -136.4 171.4 8.79 Favored Pre-proline 0 C--O 1.243 0.752 0 C-N-CA 127.182 2.193 . . . . 0.0 106.419 177.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -38.1 150.29 0.06 OUTLIER 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.933 3.089 . . . . 0.0 113.668 169.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.3 m -44.13 -41.55 5.73 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.711 1.604 . . . . 0.0 114.847 -169.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . 0.451 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 9.2 p-10 -69.74 -81.37 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.289 2.236 . . . . 0.0 112.084 177.369 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . 0.451 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 2.7 pt -53.08 114.14 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 C-N-CA 127.212 2.205 . . . . 0.0 112.842 -169.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.9 145.44 98.92 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 168.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -59.48 -31.63 94.99 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.075 1.85 . . . . 0.0 112.142 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -66.51 -45.87 78.1 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 45.0 t -59.96 -42.36 89.2 Favored 'Isoleucine or valine' 0 C--N 1.342 0.281 0 C-N-CA 123.642 0.777 . . . . 0.0 109.435 174.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.414 ' CD2' ' CZ ' ' A' ' 679' ' ' PHE . 72.8 t80 -62.25 -39.64 93.52 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.544 -176.039 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -82.28 -16.09 50.68 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.19 0.904 . . . . 0.0 112.334 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -71.28 -23.3 61.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.497 0.719 . . . . 0.0 110.346 169.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 85.5 mt -58.69 147.17 72.05 Favored Pre-proline 0 CA--C 1.538 0.482 0 O-C-N 121.115 -0.991 . . . . 0.0 109.604 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -54.92 147.78 50.21 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.457 2.105 . . . . 0.0 110.476 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -49.46 -48.31 47.68 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.481 0.712 . . . . 0.0 111.466 -175.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.37 -26.24 64.57 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.707 1.002 . . . . 0.0 113.707 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 69.7 t -71.4 -37.97 66.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 118.889 0.768 . . . . 0.0 109.277 172.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.36 -47.45 79.27 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 122.565 1.174 . . . . 0.0 107.849 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.03 -46.35 91.06 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.276 -1.329 . . . . 0.0 109.893 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.79 -39.88 91.39 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 118.733 0.697 . . . . 0.0 111.138 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -40.23 96.58 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.198 0.908 . . . . 0.0 110.396 175.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 47.5 mt -66.9 -39.81 87.52 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.463 -0.773 . . . . 0.0 110.528 175.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.87 -38.45 91.15 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.606 0.639 . . . . 0.0 110.512 174.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -62.19 -54.57 39.09 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.694 1.197 . . . . 0.0 108.428 177.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.5 m0 -66.5 -6.6 15.43 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.246 -0.909 . . . . 0.0 113.225 176.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . 0.483 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -108.96 1.56 20.75 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 117.979 -1.01 . . . . 0.0 113.06 169.735 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -117.92 -3.08 11.2 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.751 1.221 . . . . 0.0 112.661 169.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.7 p -116.16 -8.12 11.79 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.578 1.551 . . . . 0.0 110.973 174.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . 0.45 ' C ' ' HZ1' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.255 1.458 0 C-N-CA 130.099 3.714 . . . . 0.0 104.091 169.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.471 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -154.53 178.63 9.86 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.561 -0.904 . . . . 0.0 108.561 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 7.0 tpt -113.06 -168.83 1.38 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.489 1.915 . . . . 0.0 106.948 170.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 22.0 m-30 -44.59 113.28 1.66 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.216 1.006 . . . . 0.0 110.609 169.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -55.34 -34.35 88.42 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.905 3.07 . . . . 0.0 115.853 -173.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 29.0 m 115.11 -6.35 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 130.971 3.709 . . . . 0.0 109.916 -170.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -68.7 -13.72 62.55 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.507 1.923 . . . . 0.0 111.019 168.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 10.1 pt -135.2 146.57 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.992 0 C-N-CA 127.258 2.223 . . . . 0.0 109.342 -176.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -91.23 143.89 29.02 Favored Pre-proline 0 CA--C 1.541 0.615 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 167.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -57.62 -40.38 80.51 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.718 2.279 . . . . 0.0 112.561 -174.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -68.35 -43.85 76.53 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.38 -40.52 88.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.452 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 84.2 t80 -58.66 -38.64 78.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 121.681 -0.637 . . . . 0.0 112.096 176.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -80.68 -15.91 55.34 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.858 0.754 . . . . 0.0 112.727 -179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -73.36 -19.97 60.88 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.333 0.97 . . . . 0.0 110.813 169.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.77 148.82 66.82 Favored Pre-proline 0 CA--C 1.536 0.411 0 O-C-N 120.905 -1.122 . . . . 0.0 109.463 172.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -54.34 147.29 46.99 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 122.483 2.122 . . . . 0.0 110.576 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . 0.485 ' CD ' ' HZ3' ' A' ' 697' ' ' LYS . 45.1 tp10 -38.11 -58.56 0.95 Allowed 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 125.461 1.504 . . . . 0.0 110.945 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.83 -25.09 62.68 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -173.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.41 -43.47 87.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 119.351 0.978 . . . . 0.0 108.595 173.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.452 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 66.7 mt-30 -57.49 -45.5 84.83 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . 0.485 ' HZ3' ' CD ' ' A' ' 693' ' ' GLU . 11.5 mptt -71.78 -33.89 68.98 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.529 -174.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -66.63 -46.45 75.79 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.324 1.05 . . . . 0.0 111.213 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.63 -43.08 99.52 Favored 'General case' 0 N--CA 1.461 0.097 0 O-C-N 121.412 -0.805 . . . . 0.0 110.168 177.198 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.01 -41.07 91.33 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.928 -0.482 . . . . 0.0 111.008 172.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -59.48 -48.14 82.79 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 117.666 -1.159 . . . . 0.0 109.806 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -62.05 -45.63 92.72 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 120.348 1.431 . . . . 0.0 111.449 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 31.1 m0 -63.62 -14.13 48.74 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 120.501 -1.374 . . . . 0.0 112.506 175.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . 0.443 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.6 OUTLIER -101.74 -17.85 16.08 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.726 1.211 . . . . 0.0 112.928 169.56 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -67.77 -41.29 83.5 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 121.412 1.915 . . . . 0.0 109.033 171.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 17.7 p -73.38 24.33 0.07 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.913 2.085 . . . . 0.0 113.539 -172.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . 0.403 ' C ' ' HZ1' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.251 1.202 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 -172.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.562 0 N-CA-C 112.268 -0.333 . . . . 0.0 112.268 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -132.24 -19.84 2.46 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.766 1.226 . . . . 0.0 109.939 169.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 25.5 ptm -137.15 19.99 2.98 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.464 0.706 . . . . 0.0 111.624 169.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -147.33 156.13 46.15 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 128.682 2.793 . . . . 0.0 104.803 169.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.279 0.0 OUTLIER -12.15 -88.18 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.791 1 C-N-CA 126.723 4.949 . . . . 0.0 118.664 -171.661 . . . . . . . . 4 3 . 1 . 013 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 69.0 m -158.76 -39.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.785 1.175 . . . . 0.0 110.507 177.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . 0.517 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 19.0 p-10 -75.75 -74.22 0.23 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.541 1.536 . . . . 0.0 108.688 171.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . 0.517 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 6.2 pt -58.44 156.53 2.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 C-N-CA 126.422 1.889 . . . . 0.0 111.681 -176.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -141.68 169.9 10.28 Favored Pre-proline 0 C--N 1.331 -0.201 0 C-N-CA 125.786 1.634 . . . . 0.0 106.806 169.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -55.29 -36.2 93.06 Favored 'Trans proline' 0 CA--C 1.506 -0.905 0 C-N-CA 122.567 2.178 . . . . 0.0 113.81 -168.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -63.14 -56.08 19.81 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 11.9 t -61.78 -37.39 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 C-N-CA 124.305 1.042 . . . . 0.0 109.546 -173.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.434 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 75.8 t80 -75.32 -40.83 58.02 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 123.345 0.658 . . . . 0.0 111.341 -176.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -82.05 -14.1 56.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.059 0.845 . . . . 0.0 110.934 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -74.36 -9.67 58.83 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.834 1.254 . . . . 0.0 110.325 168.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 54.3 mt -76.34 152.92 83.96 Favored Pre-proline 0 CA--C 1.534 0.339 0 O-C-N 121.499 -0.751 . . . . 0.0 109.144 170.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -55.6 146.7 63.23 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.755 2.303 . . . . 0.0 110.653 177.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -46.39 -49.81 17.44 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 124.249 1.02 . . . . 0.0 111.943 -176.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.46 -28.12 66.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.316 -0.85 . . . . 0.0 113.237 -177.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 90.6 t -68.93 -38.05 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 118.922 0.783 . . . . 0.0 109.406 172.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.434 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 72.8 mt-30 -63.99 -47.7 79.33 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 -178.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.58 -46.54 89.85 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.08 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -62.66 -43.11 99.64 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.11 0.964 . . . . 0.0 111.63 -178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.0 -39.27 90.16 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.385 0.674 . . . . 0.0 110.247 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 36.0 mt -63.4 -41.37 98.75 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 118.909 0.777 . . . . 0.0 110.243 172.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.75 97.78 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.958 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -61.35 -47.09 87.49 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 119.371 0.987 . . . . 0.0 110.825 177.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 25.0 m0 -68.93 0.05 4.96 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.315 -0.866 . . . . 0.0 112.618 173.197 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . 0.513 ' HZ3' ' C ' ' A' ' 707' ' ' GLY . 1.2 tppm? -117.56 3.66 12.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.358 1.463 . . . . 0.0 112.175 168.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -95.17 -11.4 28.17 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.911 1.285 . . . . 0.0 109.53 168.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 17.1 p -122.58 -3.68 8.79 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.565 1.146 . . . . 0.0 113.69 -168.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . 0.513 ' C ' ' HZ3' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.251 1.162 0 N-CA-C 106.158 -2.777 . . . . 0.0 106.158 -175.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.595 0 CA-C-O 118.983 -0.899 . . . . 0.0 111.679 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . 0.5 ' CG ' ' H ' ' A' ' -1' ' ' MET 0.289 0.0 OUTLIER 40.82 -130.47 0.4 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 127.958 2.503 . . . . 0.0 114.421 172.72 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' MET . . . . . 0.5 ' H ' ' CG ' ' A' ' -2' ' ' HIS . 0.0 OUTLIER -101.26 -159.74 0.75 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.655 1.982 . . . . 0.0 108.671 -179.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -47.29 130.46 9.86 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 125.115 1.366 . . . . 0.0 111.64 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -54.5 -14.09 6.56 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.797 2.998 . . . . 0.0 113.642 169.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . 0.258 26.6 m 76.06 8.0 3.54 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 127.152 2.181 . . . . 0.0 113.291 174.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -74.76 -40.05 61.43 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 167.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 14.1 pt -76.0 127.22 37.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 127.204 2.202 . . . . 0.0 107.92 168.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -72.49 141.6 83.08 Favored Pre-proline 0 CA--C 1.543 0.677 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 167.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.84 -37.47 96.2 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.499 2.133 . . . . 0.0 112.057 -173.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -69.26 -42.75 75.15 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 64.9 t -59.75 -40.15 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 C-N-CA 123.359 0.664 . . . . 0.0 109.455 176.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.456 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 74.4 t80 -62.7 -42.41 99.63 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.378 -0.826 . . . . 0.0 112.016 176.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -75.96 -12.03 60.07 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.941 0.791 . . . . 0.0 112.182 -178.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -73.43 -20.75 60.64 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.446 1.021 . . . . 0.0 110.12 168.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 87.3 mt -60.07 151.04 67.84 Favored Pre-proline 0 CA--C 1.536 0.439 0 O-C-N 120.885 -1.134 . . . . 0.0 109.205 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -54.93 148.06 48.93 Favored 'Trans proline' 0 N--CA 1.452 -0.935 0 C-N-CA 122.607 2.205 . . . . 0.0 110.446 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . 0.514 ' CD ' ' HZ2' ' A' ' 697' ' ' LYS . 45.8 tp10 -41.32 -57.47 2.13 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.055 1.342 . . . . 0.0 111.262 -179.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.8 -27.96 66.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -174.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 98.9 t -67.76 -45.1 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 176.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.456 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 70.0 mt-30 -55.36 -44.5 76.06 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 122.024 0.916 . . . . 0.0 109.318 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . 0.514 ' HZ2' ' CD ' ' A' ' 693' ' ' GLU . 9.1 mptt -69.87 -41.37 74.9 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 117.622 -1.18 . . . . 0.0 110.347 -171.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -69.9 -43.77 71.07 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 119.614 1.097 . . . . 0.0 111.022 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -56.39 -46.56 80.06 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.877 0.762 . . . . 0.0 110.941 174.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 32.2 mt -69.03 -33.97 74.47 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.472 -0.767 . . . . 0.0 111.461 178.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.99 -34.74 73.74 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 119.257 0.935 . . . . 0.0 110.903 176.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -67.73 -51.81 44.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.349 1.06 . . . . 0.0 109.007 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -59.94 -34.09 72.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 120.965 -1.084 . . . . 0.0 110.9 176.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . 0.437 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.3 OUTLIER -74.99 -35.63 62.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 117.666 -1.159 . . . . 0.0 112.777 175.173 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -74.71 -14.02 60.68 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 120.877 1.671 . . . . 0.0 111.899 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 36.0 p -103.7 18.94 20.82 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.279 1.032 . . . . 0.0 111.938 -178.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.856 0 CA-C-O 117.188 -1.895 . . . . 0.0 108.724 179.098 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . 0.421 ' HA3' ' CG ' ' A' ' 684' ' ' ASP . . . . . . . . 0 N--CA 1.46 0.282 0 N-CA-C 110.622 -0.991 . . . . 0.0 110.622 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 38.2 p-80 -138.37 -9.83 1.46 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.171 1.388 . . . . 0.0 112.569 -175.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 24.8 ttt -127.54 7.33 6.32 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.811 1.244 . . . . 0.0 110.556 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -147.44 177.18 1.86 Allowed Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 127.64 2.376 . . . . 0.0 106.282 177.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -40.19 163.28 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.873 3.048 . . . . 0.0 116.127 169.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.8 m -49.68 -29.87 8.14 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.732 1.613 . . . . 0.0 115.121 -169.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -90.15 -68.5 0.78 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.664 1.586 . . . . 0.0 110.789 177.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.5 pt -66.61 162.1 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 125.877 1.671 . . . . 0.0 113.083 -171.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . 0.421 ' CG ' ' HA3' ' A' ' -3' ' ' GLY . 0.7 OUTLIER -140.84 166.29 23.81 Favored Pre-proline 0 N--CA 1.468 0.467 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 169.684 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -56.9 -34.67 97.57 Favored 'Trans proline' 0 CA--C 1.505 -0.958 0 C-N-CA 122.533 2.156 . . . . 0.0 113.666 -168.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -63.38 -55.71 22.19 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -178.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 17.6 t -65.93 -34.46 70.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 124.218 1.007 . . . . 0.0 109.431 -173.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.438 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 79.5 t80 -70.74 -41.74 71.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 121.893 -0.504 . . . . 0.0 111.495 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -82.63 -13.75 55.93 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.232 0.924 . . . . 0.0 111.015 -179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -71.59 -17.17 62.3 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.36 1.064 . . . . 0.0 109.954 168.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 70.4 mt -66.55 152.51 94.83 Favored Pre-proline 0 C--N 1.344 0.364 0 O-C-N 121.199 -0.938 . . . . 0.0 109.765 174.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -55.06 147.12 54.92 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.023 2.482 . . . . 0.0 110.252 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -46.62 -50.74 17.11 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 124.181 0.993 . . . . 0.0 112.436 -172.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.0 93.35 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 57.8 t -61.23 -38.09 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 O-C-N 121.357 -0.839 . . . . 0.0 109.531 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.438 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 60.8 mt-30 -64.0 -48.12 77.65 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.222 0.465 . . . . 0.0 110.468 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.6 -48.53 80.52 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -176.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.51 -37.03 76.99 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 122.736 0.414 . . . . 0.0 110.344 -173.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.55 -42.53 91.75 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.829 0.741 . . . . 0.0 110.192 175.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.03 -40.68 94.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.796 0.725 . . . . 0.0 110.711 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.59 -38.23 70.89 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.57 0.623 . . . . 0.0 111.912 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 39.8 tp10 -69.42 -41.65 76.07 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.43 1.092 . . . . 0.0 110.099 -179.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -61.31 -45.33 94.91 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.185 -0.947 . . . . 0.0 109.087 170.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.5 tptp -60.83 -24.51 65.93 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.504 1.047 . . . . 0.0 112.96 176.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -73.01 -11.73 60.67 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.307 1.043 . . . . 0.0 112.166 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.57 -13.46 1.99 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -168.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.848 0 N-CA-C 105.072 -3.211 . . . . 0.0 105.072 170.188 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.516 0 N-CA-C 107.683 -2.167 . . . . 0.0 107.683 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -73.85 25.95 0.07 Allowed 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 118.63 1.215 . . . . 0.0 113.529 -175.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 11.3 tpt -155.92 153.51 29.75 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.941 2.096 . . . . 0.0 105.906 170.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.26 132.83 52.0 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-O 117.654 -1.165 . . . . 0.0 107.903 170.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.88 -25.09 26.29 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.453 2.102 . . . . 0.0 113.441 170.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 15.2 m 67.27 15.45 9.97 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.88 1.672 . . . . 0.0 113.692 173.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -76.76 -41.09 46.15 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.605 1.562 . . . . 0.0 107.577 168.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.1 pt -81.89 139.2 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 C-N-CA 128.021 2.528 . . . . 0.0 108.301 169.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -73.57 144.2 83.2 Favored Pre-proline 0 CA--C 1.542 0.66 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 168.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -60.66 -38.07 74.66 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 121.727 1.618 . . . . 0.0 111.526 -175.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -63.62 -47.39 81.61 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 58.4 t -61.71 -37.12 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -176.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.433 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 86.5 t80 -62.83 -47.49 83.2 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.389 -0.82 . . . . 0.0 112.235 171.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -74.22 -14.22 60.9 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.204 -0.935 . . . . 0.0 111.701 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -73.82 -14.54 61.11 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.676 1.19 . . . . 0.0 110.646 169.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 77.3 mt -64.77 152.74 89.64 Favored Pre-proline 0 CA--C 1.537 0.445 0 O-C-N 121.022 -1.049 . . . . 0.0 109.697 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -55.3 144.07 73.17 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.139 2.559 . . . . 0.0 109.945 177.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -44.94 -50.09 10.71 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.613 1.165 . . . . 0.0 112.079 -174.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.46 -32.3 73.05 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 97.4 t -67.11 -40.1 84.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 176.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.433 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 74.0 mt-30 -62.54 -48.67 78.51 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 -177.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -45.04 79.53 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.114 -175.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -67.5 -43.18 81.52 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.02 0.827 . . . . 0.0 111.598 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -63.06 -35.98 82.07 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 120.988 -1.07 . . . . 0.0 112.249 174.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 39.9 mt -69.7 -38.2 76.88 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 177.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.48 -36.84 83.76 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.684 -0.674 . . . . 0.0 110.352 173.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -63.8 -54.08 40.8 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.528 1.131 . . . . 0.0 109.456 176.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 31.3 m0 -62.36 -25.34 67.86 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 120.846 -1.159 . . . . 0.0 111.587 177.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . 0.44 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.5 OUTLIER -81.39 -32.81 32.66 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 117.177 -1.392 . . . . 0.0 112.766 173.28 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -82.34 -27.51 32.16 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.977 1.717 . . . . 0.0 111.432 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 27.9 p -86.72 155.36 20.39 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.91 0 N-CA-C 107.422 -2.271 . . . . 0.0 107.422 168.867 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.149 0 CA-C-O 118.835 -0.98 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -132.76 -3.25 3.27 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 118.039 0.919 . . . . 0.0 112.32 -169.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -172.35 -47.91 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.95 2.1 . . . . 0.0 105.59 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . 0.428 ' CZ ' ' CD2' ' A' ' 688' ' ' PHE . 24.8 m-85 -76.74 170.64 15.23 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 124.501 1.12 . . . . 0.0 108.24 168.136 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -39.47 161.09 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 125.008 3.805 . . . . 0.0 116.446 171.144 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 5.8 m -45.62 -35.78 4.3 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 126.604 1.962 . . . . 0.0 115.849 -169.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -81.26 -61.98 1.79 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.621 1.1 . . . . 0.0 110.494 174.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.23 168.34 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 125.247 2.451 . . . . 0.0 114.512 -169.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -146.56 148.95 35.52 Favored Pre-proline 0 C--N 1.322 -0.613 0 C-N-CA 129.288 3.035 . . . . 0.0 104.551 -173.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -59.97 -33.63 95.51 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 CA-C-N 121.892 1.712 . . . . 0.0 112.516 -174.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -63.61 -50.45 69.32 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 109.074 -0.714 . . . . 0.0 109.074 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 29.9 t -64.51 -38.61 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 C-N-CA 123.674 0.79 . . . . 0.0 109.086 -178.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.428 ' CD2' ' CZ ' ' A' ' 679' ' ' PHE . 70.3 t80 -68.07 -40.93 82.6 Favored 'General case' 0 N--CA 1.444 -0.762 0 O-C-N 121.632 -0.667 . . . . 0.0 111.658 -177.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -81.57 -14.48 56.76 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.989 0.813 . . . . 0.0 111.811 -179.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -67.91 -24.67 65.23 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.671 0.789 . . . . 0.0 109.747 169.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 55.6 mt -63.28 148.53 93.09 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 121.604 -0.685 . . . . 0.0 109.546 173.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -55.62 147.87 57.18 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.726 2.284 . . . . 0.0 110.691 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -47.59 -49.71 26.01 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.879 0.872 . . . . 0.0 111.718 -175.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.54 -27.24 66.8 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -177.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 97.0 t -71.66 -36.74 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 118.826 0.739 . . . . 0.0 109.386 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -65.0 -44.83 87.93 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 122.248 1.023 . . . . 0.0 108.493 -178.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.13 -50.74 70.69 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.184 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -65.18 -38.34 90.2 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 122.955 0.502 . . . . 0.0 111.421 -176.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.85 -42.29 95.01 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 119.986 1.266 . . . . 0.0 110.083 177.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.95 -36.5 84.18 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.329 0.513 . . . . 0.0 110.832 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.26 -37.75 71.93 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.379 0.672 . . . . 0.0 111.123 176.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.91 -50.95 62.62 Favored 'General case' 0 CA--C 1.516 -0.343 0 C-N-CA 125.037 1.335 . . . . 0.0 108.65 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -57.51 -48.25 79.76 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 121.561 -0.712 . . . . 0.0 109.151 174.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.6 tpmp? -69.12 -11.0 60.4 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 117.329 -1.319 . . . . 0.0 113.928 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -105.09 6.06 32.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 121.45 1.932 . . . . 0.0 111.839 173.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 34.8 p -125.66 -17.17 5.55 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.028 0.931 . . . . 0.0 111.861 176.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 N-CA-C 106.856 -2.497 . . . . 0.0 106.856 169.991 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . 0.481 ' H1 ' ' CG ' ' A' ' 682' ' ' ASP . . . . . . . . 0 CA--C 1.528 0.852 0 CA-C-O 118.624 -1.098 . . . . 0.0 112.347 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . 0.268 0.0 OUTLIER 52.92 2.11 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 131.321 3.848 . . . . 0.0 118.954 176.16 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 25.6 ptm -161.43 -1.19 0.05 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -170.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -100.92 157.75 33.09 Favored Pre-proline 0 CA--C 1.541 0.613 0 CA-C-N 120.2 1.364 . . . . 0.0 110.089 -169.669 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -54.57 138.79 75.54 Favored 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 121.927 1.752 . . . . 0.0 110.846 168.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 16.9 m 46.78 24.79 0.37 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.066 1.347 . . . . 0.0 112.92 -170.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . 0.481 ' CG ' ' H1 ' ' A' ' -3' ' ' GLY 0.374 12.2 t0 32.25 41.0 0.02 OUTLIER 'General case' 0 C--O 1.233 0.234 0 C-N-CA 129.537 3.135 . . . . 0.0 116.114 -169.076 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 4.5 pt -53.13 148.62 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 122.797 1.284 . . . . 0.0 109.343 169.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -70.84 135.9 85.44 Favored Pre-proline 0 N--CA 1.444 -0.729 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 170.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -55.19 -36.69 93.83 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.854 1.703 . . . . 0.0 111.452 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -64.94 -44.5 89.28 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -176.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 51.4 t -69.06 -42.58 82.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -56.56 -45.11 81.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.157 -0.964 . . . . 0.0 113.444 173.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -84.93 -5.75 59.34 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 118.763 0.71 . . . . 0.0 111.587 -174.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -77.04 -22.38 53.05 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.783 1.233 . . . . 0.0 109.252 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 91.3 mt -58.98 150.55 60.44 Favored Pre-proline 0 CA--C 1.534 0.346 0 O-C-N 121.389 -0.82 . . . . 0.0 109.968 175.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -53.49 147.63 37.42 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 123.253 2.635 . . . . 0.0 110.631 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -48.73 -48.59 40.45 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.602 0.761 . . . . 0.0 111.428 -174.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.85 -25.79 63.9 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -178.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 89.3 t -70.9 -43.77 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 119.288 0.949 . . . . 0.0 108.858 172.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -58.52 -47.26 84.73 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.66 0.664 . . . . 0.0 109.314 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.72 -43.26 97.06 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 117.973 -1.013 . . . . 0.0 109.904 -179.219 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -66.8 -39.14 87.64 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 119.255 0.934 . . . . 0.0 111.038 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -42.87 96.2 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 121.409 -0.807 . . . . 0.0 109.467 176.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 32.2 mt -63.79 -40.97 97.94 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.967 0.803 . . . . 0.0 110.911 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -62.52 -40.92 98.32 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.726 -0.655 . . . . 0.0 110.337 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -60.13 -54.46 45.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 26.9 m0 -66.99 0.23 2.69 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.524 1.13 . . . . 0.0 113.261 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . 0.488 ' HZ1' ' C ' ' A' ' 707' ' ' GLY . 1.2 tppm? -125.55 10.91 7.91 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.786 -1.196 . . . . 0.0 113.63 169.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -117.99 13.91 14.03 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.714 1.206 . . . . 0.0 110.542 169.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 24.7 p -131.92 -7.41 3.52 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.148 1.779 . . . . 0.0 111.518 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . 0.488 ' C ' ' HZ1' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.253 1.289 0 N-CA-C 104.665 -3.374 . . . . 0.0 104.665 -169.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.955 0 CA-C-O 117.271 -1.85 . . . . 0.0 116.008 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 57.2 t60 65.19 -44.43 0.35 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 118.493 2.775 . . . . 0.0 118.493 174.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.82 171.39 19.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 120.589 1.541 . . . . 0.0 109.665 -172.681 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.25 132.89 90.42 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 171.082 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -62.21 -160.61 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.528 3.485 . . . . 0.0 112.108 168.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 14.4 m -148.58 17.73 1.03 Allowed 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.413 -1.429 . . . . 0.0 111.736 176.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -87.71 -38.66 15.63 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.375 1.47 . . . . 0.0 109.219 169.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 12.9 pt -83.9 145.26 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 C-N-CA 124.845 1.258 . . . . 0.0 110.669 170.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -84.3 142.59 40.92 Favored Pre-proline 0 CA--C 1.541 0.632 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 168.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -74.77 -29.0 9.13 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 CA-C-N 120.286 1.138 . . . . 0.0 111.064 -171.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -69.14 -43.76 73.71 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 119.481 1.037 . . . . 0.0 109.09 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 92.2 t -56.58 -44.82 81.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 174.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . 0.409 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 90.7 t80 -59.58 -43.14 93.72 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 175.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -78.13 -13.08 60.0 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.761 1.164 . . . . 0.0 112.367 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -82.09 -7.01 59.6 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.019 0.928 . . . . 0.0 110.933 168.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 71.8 mt -65.61 152.91 91.75 Favored Pre-proline 0 CA--C 1.534 0.354 0 O-C-N 121.036 -1.04 . . . . 0.0 109.083 169.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -55.2 145.99 62.5 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.074 2.516 . . . . 0.0 110.511 178.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 32.3 tp10 -46.21 -50.18 16.16 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.267 1.027 . . . . 0.0 112.09 -174.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.88 -29.47 67.77 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -177.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 94.2 t -68.04 -41.34 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.409 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.3 mt-30 -63.31 -46.68 85.55 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 -177.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -40.9 85.74 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 117.393 -1.289 . . . . 0.0 110.57 -175.312 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . 0.41 ' CD ' HH22 ' A' ' 705' ' ' ARG . 19.4 tp10 -69.8 -43.69 71.56 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 119.921 1.237 . . . . 0.0 111.146 179.121 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.76 -42.87 99.55 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 121.132 -0.98 . . . . 0.0 111.041 177.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 27.5 mt -64.69 -39.52 93.81 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.394 0.543 . . . . 0.0 110.696 176.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -56.38 -55.97 26.94 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-O 115.968 -1.968 . . . . 0.0 108.537 170.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -49.32 -49.16 45.22 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 122.558 2.436 . . . . 0.0 110.122 175.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -70.56 -4.51 23.4 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -175.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 1.7 tppm? -135.67 -5.97 2.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 121.148 1.795 . . . . 0.0 115.029 169.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . 0.41 HH22 ' CD ' ' A' ' 698' ' ' GLU . 29.7 ttm180 -77.19 -37.51 53.42 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 127.184 2.194 . . . . 0.0 109.095 170.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.52 61.34 0.72 Allowed 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 -168.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.039 0 N-CA-C 109.364 -1.494 . . . . 0.0 109.364 -169.619 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.362 0 N-CA-C 108.795 -1.722 . . . . 0.0 108.795 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -146.7 169.05 19.83 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 170.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 12.5 tpt -56.22 -22.73 31.19 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.006 0.923 . . . . 0.0 113.038 -172.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -147.11 152.95 44.52 Favored Pre-proline 0 N--CA 1.449 -0.483 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 168.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -60.48 -36.78 84.97 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.816 2.344 . . . . 0.0 112.297 177.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 19.3 m 116.93 16.57 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 131.528 3.931 . . . . 0.0 110.39 -178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -114.97 -37.94 4.03 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.761 1.624 . . . . 0.0 112.808 -169.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.3 pt -92.1 138.65 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.723 1.209 . . . . 0.0 111.617 -173.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -65.69 138.75 96.77 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 168.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.61 -28.12 10.2 Favored 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 121.278 1.319 . . . . 0.0 111.165 -169.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 23.6 mm100 -69.1 -46.77 66.91 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 119.484 1.038 . . . . 0.0 108.436 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 89.3 t -57.99 -36.03 54.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.339 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -68.89 -53.04 23.4 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 119.363 0.983 . . . . 0.0 113.608 169.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -75.87 -10.64 59.6 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.968 -1.082 . . . . 0.0 112.954 -169.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -83.91 -1.87 55.37 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.808 1.243 . . . . 0.0 111.196 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 58.7 mt -70.59 156.65 91.63 Favored Pre-proline 0 CA--C 1.535 0.397 0 O-C-N 120.859 -1.151 . . . . 0.0 109.415 169.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -56.33 142.77 87.92 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.251 2.634 . . . . 0.0 110.696 177.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.02 -36.06 67.54 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.688 0.795 . . . . 0.0 112.948 -172.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.96 -33.27 70.29 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.297 -0.877 . . . . 0.0 113.093 175.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 75.5 t -65.11 -43.34 95.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 173.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -56.48 -53.12 61.21 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -53.45 -41.36 66.06 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 118.089 -0.958 . . . . 0.0 113.03 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -42.31 84.37 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.75 0.705 . . . . 0.0 110.193 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -66.08 -36.21 82.59 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 120.999 -1.063 . . . . 0.0 112.569 174.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.56 -44.51 96.08 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.711 1.141 . . . . 0.0 108.753 172.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.99 96.55 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.511 177.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.13 -46.17 90.54 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 119.937 1.244 . . . . 0.0 110.437 177.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 38.9 m0 -64.72 -14.1 57.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 120.653 -1.28 . . . . 0.0 112.099 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 704' ' ' LYS . . . . . 0.458 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.5 OUTLIER -103.64 -17.33 15.19 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 117.749 -1.119 . . . . 0.0 112.51 168.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 80.7 mtm-85 -69.72 -40.68 76.09 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 121.41 1.914 . . . . 0.0 109.244 169.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 20.7 p -77.21 29.79 0.14 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.075 1.75 . . . . 0.0 113.244 -169.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 707' ' ' GLY . . . . . 0.429 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.242 0.642 0 N-CA-C 108.763 -1.735 . . . . 0.0 108.763 -170.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 N--CA 1.46 -0.475 0 N-CA-C 118.91 2.619 . . . . 0.0 118.91 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 67.6 m -160.17 -40.27 0.05 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.751 1.159 . . . . 0.0 110.815 177.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -77.55 -63.09 1.46 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.318 1.447 . . . . 0.0 109.343 176.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 1.4 pt -61.71 116.91 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 C-N-CA 125.49 1.516 . . . . 0.0 110.728 -172.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.53 157.83 63.97 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 168.291 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -56.72 -42.56 63.69 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.573 2.182 . . . . 0.0 111.093 -169.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -63.86 -43.53 95.81 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 123.728 0.642 . . . . 0.0 110.003 -176.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 15.6 t -65.94 -36.89 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.752 0.821 . . . . 0.0 109.785 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -64.37 -37.9 89.13 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.429 -0.794 . . . . 0.0 111.19 174.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -81.47 -14.38 57.08 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 118.933 0.788 . . . . 0.0 112.658 -178.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -73.63 -16.16 61.24 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.991 1.317 . . . . 0.0 110.723 169.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 81.1 mt -66.97 150.82 97.67 Favored Pre-proline 0 CA--C 1.533 0.306 0 O-C-N 121.521 -0.737 . . . . 0.0 109.186 171.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -54.97 142.46 76.16 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.372 2.048 . . . . 0.0 110.33 173.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.89 -35.68 61.87 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.984 0.914 . . . . 0.0 112.178 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -72.47 -28.66 63.05 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 61.2 t -70.68 -37.46 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 172.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -62.26 -50.37 72.01 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -176.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -49.18 -48.24 45.31 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.79 1.236 . . . . 0.0 113.363 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -41.74 96.33 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 118.527 0.603 . . . . 0.0 110.412 -179.334 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.98 -32.52 73.88 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.151 -0.968 . . . . 0.0 111.948 175.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.34 -40.35 97.05 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 119.734 1.152 . . . . 0.0 109.885 171.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.12 -34.32 70.95 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.257 176.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.39 -51.71 61.84 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 124.377 1.071 . . . . 0.0 109.598 176.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 21.2 m0 -59.94 -46.31 89.81 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 175.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.6 tptp -69.16 -11.35 60.72 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 120.357 1.435 . . . . 0.0 113.771 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -104.14 5.0 34.73 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 121.417 1.917 . . . . 0.0 111.821 172.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 29.5 p -124.42 -14.96 6.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.56 0.744 . . . . 0.0 112.202 174.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 N-CA-C 106.9 -2.48 . . . . 0.0 106.9 170.352 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo . . . . . 0 CA--C 1.537 0.653 0 CA-C-O 122.394 0.914 . . . . 0.0 113.613 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 2.3 m -48.82 -37.84 20.47 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.446 1.498 . . . . 0.0 114.331 -169.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -79.75 -70.34 0.52 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.503 1.521 . . . . 0.0 110.887 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 1.5 pt -62.04 117.25 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 C-N-CA 125.739 1.615 . . . . 0.0 110.846 -170.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.14 160.43 62.9 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 169.149 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -58.96 -38.29 88.88 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.419 2.079 . . . . 0.0 111.563 -174.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -56.92 -54.62 44.49 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 124.011 0.819 . . . . 0.0 110.019 175.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 11.2 t -65.33 -33.59 64.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 C-N-CA 123.015 0.526 . . . . 0.0 109.618 -174.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.427 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 75.7 t80 -68.44 -39.42 81.53 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.985 -0.447 . . . . 0.0 112.139 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -84.34 -16.94 41.12 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.904 0.774 . . . . 0.0 111.653 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -71.81 -13.93 61.83 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.687 1.195 . . . . 0.0 110.41 169.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.02 151.97 96.55 Favored Pre-proline 0 CA--C 1.536 0.408 0 O-C-N 121.436 -0.79 . . . . 0.0 109.349 169.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -55.03 144.12 70.24 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.421 2.08 . . . . 0.0 110.091 175.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -30.87 -63.84 0.14 Allowed 'General case' 0 C--O 1.232 0.146 0 C-N-CA 126.922 2.089 . . . . 0.0 111.328 175.1 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.58 -23.94 64.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -172.025 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 80.6 t -69.48 -36.25 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 119.17 0.895 . . . . 0.0 109.374 173.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.427 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 59.6 mt-30 -65.93 -46.32 78.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -67.83 -41.92 82.27 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 114.381 -1.281 . . . . 0.0 109.325 -175.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -65.63 -41.36 92.75 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 119.094 -0.479 . . . . 0.0 110.884 176.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -36.29 83.9 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 119.563 1.074 . . . . 0.0 110.696 177.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 44.6 mt -67.42 -41.54 84.68 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.835 0.743 . . . . 0.0 110.204 174.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.46 -37.13 86.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.281 0.491 . . . . 0.0 110.672 173.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -63.88 -55.19 24.59 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.654 1.182 . . . . 0.0 108.315 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -65.85 -7.84 18.59 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.329 -0.857 . . . . 0.0 112.877 175.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 704' ' ' LYS . . . . . 0.498 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -107.74 2.5 23.74 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.324 169.915 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -119.34 -2.72 10.57 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.667 1.187 . . . . 0.0 112.364 169.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.9 p -115.84 -7.35 12.05 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.48 1.512 . . . . 0.0 110.962 173.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.882 0 C-N-CA 130.217 3.77 . . . . 0.0 104.072 169.567 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo . . . . . 0 N--CA 1.457 -0.638 0 CA-C-O 118.608 -0.663 . . . . 0.0 113.091 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 11.2 m 46.99 26.39 0.59 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.481 1.512 . . . . 0.0 114.779 169.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . 0.267 23.5 t0 51.99 32.63 10.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.719 2.008 . . . . 0.0 114.471 -174.126 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 683' ' ' ILE . . . . . 0.401 HG21 HD13 ' A' ' 683' ' ' ILE . 22.9 mt -70.52 173.61 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 168.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.41 147.47 37.1 Favored Pre-proline 0 C--N 1.321 -0.646 0 N-CA-C 105.836 -1.912 . . . . 0.0 105.836 169.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -65.33 -34.91 42.61 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 CA-C-N 120.775 1.313 . . . . 0.0 111.549 -169.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -65.61 -48.65 71.54 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 176.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 49.4 t -55.05 -33.71 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 123.5 0.72 . . . . 0.0 110.224 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 65.6 t80 -75.52 -47.99 24.5 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 178.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -78.56 -11.95 59.99 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.032 -1.043 . . . . 0.0 111.728 -175.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -70.53 -20.47 62.81 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.085 1.354 . . . . 0.0 109.751 168.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 73.3 mt -65.6 151.52 94.41 Favored Pre-proline 0 CA--C 1.533 0.297 0 O-C-N 121.393 -0.817 . . . . 0.0 109.47 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_exo -54.39 146.88 49.37 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.222 2.615 . . . . 0.0 110.031 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.3 tp10 -47.63 -49.5 26.98 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.553 0.741 . . . . 0.0 112.021 -173.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -66.78 -30.45 70.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 93.3 t -68.14 -39.3 81.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 175.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.417 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 73.6 mt-30 -64.07 -45.13 90.14 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 122.315 1.055 . . . . 0.0 108.214 -178.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.08 -52.42 65.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.42 -1.263 . . . . 0.0 109.917 -178.804 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -64.64 -36.74 85.23 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 118.941 0.791 . . . . 0.0 111.599 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -38.61 86.18 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.018 0.826 . . . . 0.0 110.33 177.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 31.0 mt -68.49 -38.07 80.66 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 119.546 1.066 . . . . 0.0 110.42 174.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.49 -38.84 92.69 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.685 0.675 . . . . 0.0 110.242 173.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.27 -55.33 33.18 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 124.164 0.985 . . . . 0.0 108.775 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -67.16 -6.22 16.88 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.088 -1.007 . . . . 0.0 112.841 177.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 704' ' ' LYS . . . . . 0.501 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -110.3 3.01 19.5 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.402 1.001 . . . . 0.0 112.903 170.321 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -117.96 -9.55 10.57 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.528 1.131 . . . . 0.0 112.319 169.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.5 p -108.87 -5.68 16.09 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.465 1.506 . . . . 0.0 111.518 173.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.271 0 N-CA-C 104.32 -3.512 . . . . 0.0 104.32 169.461 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo . . . . . 0 CA--C 1.545 1.064 0 CA-C-O 121.559 0.566 . . . . 0.0 112.243 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 12.9 m -145.64 9.0 1.17 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.191 -1.568 . . . . 0.0 112.942 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -77.37 -0.65 26.5 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.704 1.602 . . . . 0.0 111.933 169.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 8.8 pt -145.05 163.14 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 C-N-CA 127.436 2.294 . . . . 0.0 108.479 -172.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.75 150.42 37.71 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 125.331 1.452 . . . . 0.0 107.207 170.067 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -66.53 -37.48 22.38 Favored 'Trans proline' 0 N--CA 1.452 -0.957 0 C-N-CA 123.0 2.466 . . . . 0.0 113.413 -173.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 19.5 mm100 -68.25 -46.66 69.87 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 86.1 t -56.37 -40.51 67.26 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -64.26 -52.71 57.34 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 173.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -69.33 -26.13 64.55 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.572 1.078 . . . . 0.0 111.569 -171.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -71.13 -7.82 49.24 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.818 1.647 . . . . 0.0 112.461 171.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 51.6 mt -65.07 153.83 88.16 Favored Pre-proline 0 CA--C 1.537 0.47 0 O-C-N 120.746 -1.221 . . . . 0.0 109.62 169.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -53.63 142.45 60.73 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.405 2.737 . . . . 0.0 109.851 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -48.75 -41.51 32.41 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 123.683 0.793 . . . . 0.0 112.786 -172.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -73.65 -31.69 63.62 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 72.8 t -66.2 -48.17 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 170.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -55.03 -43.56 73.83 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 123.854 0.862 . . . . 0.0 110.919 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.41 -45.41 91.11 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 117.537 -1.22 . . . . 0.0 110.459 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -71.02 -39.92 72.06 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.742 1.156 . . . . 0.0 111.342 -177.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 699' ' ' LEU . . . . . 0.505 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 0.8 OUTLIER -64.36 -44.97 89.76 Favored 'General case' 0 C--O 1.226 -0.163 0 O-C-N 121.47 -0.769 . . . . 0.0 110.974 175.332 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 61.3 mt -58.15 -39.86 79.88 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 119.147 0.885 . . . . 0.0 109.821 173.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -64.92 -44.67 88.77 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 117.412 -1.28 . . . . 0.0 111.089 178.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.98 -50.48 64.04 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.639 1.563 . . . . 0.0 108.825 172.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 703' ' ' TRP . . . . . 0.505 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 49.6 m0 -68.23 -9.04 44.29 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.026 1.33 . . . . 0.0 113.532 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -110.31 -3.36 16.25 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.734 0.814 . . . . 0.0 112.182 169.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -91.32 -6.61 52.81 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.208 0.913 . . . . 0.0 109.509 168.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 54.4 p -131.08 4.63 4.44 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 114.131 1.159 . . . . 0.0 114.131 -169.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 N-CA-C 106.312 -2.715 . . . . 0.0 106.312 -176.052 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo . . . . . 0 CA--C 1.535 0.537 0 N-CA-C 114.906 1.079 . . . . 0.0 114.906 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.7 m -40.6 -39.33 1.03 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.651 1.98 . . . . 0.0 116.32 -169.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 16.4 p-10 -82.27 -69.05 0.65 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.972 1.309 . . . . 0.0 110.517 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.5 pt -62.38 160.46 2.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 125.807 1.643 . . . . 0.0 112.577 -172.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.57 166.48 20.66 Favored Pre-proline 0 N--CA 1.464 0.257 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 169.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -54.81 -37.99 92.24 Favored 'Trans proline' 0 CA--C 1.505 -0.973 0 C-N-CA 122.553 2.169 . . . . 0.0 113.725 -168.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -61.6 -54.84 37.58 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 13.9 t -65.89 -34.18 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 124.471 1.108 . . . . 0.0 109.811 -173.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 66.6 t80 -72.31 -37.4 68.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 122.906 0.482 . . . . 0.0 111.848 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -83.07 -16.86 45.28 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.547 0.612 . . . . 0.0 111.301 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -71.56 -12.55 61.42 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.544 1.138 . . . . 0.0 110.872 169.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 69.7 mt -73.61 152.44 89.5 Favored Pre-proline 0 CA--C 1.539 0.538 0 O-C-N 121.313 -0.867 . . . . 0.0 109.766 174.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -56.47 155.64 24.92 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 123.194 2.596 . . . . 0.0 111.528 172.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -42.07 46.9 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.527 0.731 . . . . 0.0 110.81 176.132 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -62.11 -53.46 55.16 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 -176.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 41.3 t -60.15 -32.47 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.476 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.9 mt-30 -68.84 -55.9 9.69 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 120.071 1.305 . . . . 0.0 108.606 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 697' ' ' LYS . . . . . 0.414 ' HE3' ' HB3' ' A' ' 697' ' ' LYS 0.335 0.0 OUTLIER -74.24 -30.79 62.32 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.248 -169.404 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -68.23 -39.97 82.15 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 119.671 1.123 . . . . 0.0 109.101 170.349 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -36.94 85.72 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.561 1.073 . . . . 0.0 110.116 174.497 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 15.1 mt -62.47 -42.26 99.36 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 119.114 0.87 . . . . 0.0 110.143 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.0 -42.17 81.15 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.869 0.759 . . . . 0.0 110.827 178.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -59.26 -53.19 61.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.142 1.377 . . . . 0.0 109.454 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -66.88 -32.15 73.22 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 118.408 -0.806 . . . . 0.0 110.923 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 704' ' ' LYS . . . . . 0.42 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -60.72 -25.94 66.81 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 119.566 1.075 . . . . 0.0 111.829 174.254 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -64.44 -12.39 43.01 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.963 1.256 . . . . 0.0 113.543 170.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 1.9 p -130.17 -17.36 3.45 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -169.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 N-CA-C 105.903 -2.879 . . . . 0.0 105.903 176.375 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo . . . . . 0 CA--C 1.537 0.637 0 CA-C-O 121.15 0.396 . . . . 0.0 112.288 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 2.2 m -45.96 -39.34 8.8 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 114.781 1.401 . . . . 0.0 114.781 -168.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 682' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 11.7 p-10 -66.15 -85.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.885 2.074 . . . . 0.0 111.021 173.242 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 683' ' ' ILE . . . . . 0.407 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 4.0 pt -55.16 118.21 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 C-N-CA 125.533 1.533 . . . . 0.0 110.107 -169.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.6 152.78 67.34 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 170.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -57.38 -37.17 98.32 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.163 2.575 . . . . 0.0 111.771 -169.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 686' ' ' GLN . . . . . 0.428 ' CD ' ' H ' ' A' ' 686' ' ' GLN . 2.5 mp0 -56.41 -55.37 34.37 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 5.2 t -60.82 -37.28 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 C-N-CA 124.532 1.133 . . . . 0.0 109.607 -176.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 72.0 t80 -69.61 -40.76 76.43 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 119.068 -0.491 . . . . 0.0 112.029 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -77.0 -20.29 56.23 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.456 1.026 . . . . 0.0 111.281 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -70.52 -11.22 60.79 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.282 1.033 . . . . 0.0 111.524 169.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 83.1 mt -70.59 152.32 95.34 Favored Pre-proline 0 CA--C 1.535 0.379 0 O-C-N 121.057 -1.027 . . . . 0.0 109.139 169.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -53.98 147.34 43.25 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.464 2.109 . . . . 0.0 110.162 175.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -40.95 -57.51 1.97 Allowed 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.069 1.348 . . . . 0.0 111.05 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.01 -25.04 63.4 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -173.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 78.9 t -67.31 -45.14 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 62.9 mt-30 -55.53 -43.24 75.59 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.249 0.547 . . . . 0.0 109.645 178.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -74.21 -40.75 62.25 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.218 -173.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -62.99 -40.08 96.7 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 119.219 0.918 . . . . 0.0 110.862 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.3 -38.61 91.65 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 119.468 1.031 . . . . 0.0 111.272 177.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.19 -44.38 84.15 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.923 0.783 . . . . 0.0 110.116 174.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.13 82.9 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 119.148 -0.453 . . . . 0.0 110.58 174.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.75 -54.83 33.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.463 1.105 . . . . 0.0 108.113 178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 22.1 m0 -65.73 -2.84 4.0 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.285 1.034 . . . . 0.0 113.045 176.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -117.13 5.06 12.71 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.861 1.209 . . . . 0.0 113.759 169.067 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 19.1 ptt180 -117.93 9.46 12.84 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.638 1.175 . . . . 0.0 111.461 169.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 28.8 p -125.9 -3.56 7.06 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.206 1.402 . . . . 0.0 111.884 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.577 0 N-CA-C 105.388 -3.085 . . . . 0.0 105.388 -172.645 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 CA--C 1.54 0.814 0 N-CA-C 114.826 1.048 . . . . 0.0 114.826 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 4.2 m -60.67 -30.3 69.83 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.418 1.087 . . . . 0.0 113.539 -172.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -69.06 -9.94 55.07 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.848 2.459 . . . . 0.0 114.111 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 13.1 pt -145.82 -178.24 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 125.549 1.54 . . . . 0.0 108.323 -174.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -152.03 162.75 25.73 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 168.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -57.51 -36.71 98.65 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.213 1.942 . . . . 0.0 113.577 -168.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -62.37 -53.46 54.71 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -177.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 4.1 t -68.73 -33.19 58.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.748 -173.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.47 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 66.6 t80 -65.73 -39.39 91.09 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 118.391 0.541 . . . . 0.0 111.161 177.206 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -81.4 -16.6 51.67 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.68 -0.638 . . . . 0.0 111.551 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -75.18 -13.22 60.44 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.168 0.894 . . . . 0.0 110.832 169.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 64.6 mt -68.84 152.32 96.82 Favored Pre-proline 0 C--N 1.344 0.357 0 O-C-N 121.075 -1.016 . . . . 0.0 109.216 170.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -53.65 144.74 51.74 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.382 2.055 . . . . 0.0 110.745 173.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.05 -34.35 65.82 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.598 0.759 . . . . 0.0 112.791 -176.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.5 -38.78 74.38 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.701 -0.624 . . . . 0.0 112.49 173.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 96.2 t -61.53 -37.11 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 O-C-N 120.88 -1.137 . . . . 0.0 109.559 175.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.47 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 68.5 mt-30 -58.52 -53.93 52.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -51.75 -52.44 48.65 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.19 -36.14 79.11 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -171.077 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.03 -38.67 89.59 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.495 171.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.75 -38.35 87.66 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-N 119.425 1.012 . . . . 0.0 110.343 173.522 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.47 72.67 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.561 0.619 . . . . 0.0 110.901 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -60.44 -52.28 65.9 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 176.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.4 m0 -58.61 -46.1 87.75 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 118.531 -0.747 . . . . 0.0 110.06 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -68.13 -19.56 64.83 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 120.405 1.457 . . . . 0.0 112.643 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -84.87 -4.68 59.2 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 120.692 1.587 . . . . 0.0 113.083 169.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 37.5 p -126.3 -15.26 5.74 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.165 1.348 . . . . 0.0 112.325 -171.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.975 0 N-CA-C 106.282 -2.727 . . . . 0.0 106.282 169.869 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo . . . . . 0 CA--C 1.536 0.621 0 N-CA-C 114.869 1.065 . . . . 0.0 114.869 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 5.0 m -55.55 -27.37 48.59 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.173 1.545 . . . . 0.0 115.173 -169.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -91.03 -7.78 50.91 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.615 1.966 . . . . 0.0 113.512 -172.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.3 pt -140.05 170.27 15.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 125.72 1.608 . . . . 0.0 108.569 -174.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -151.82 170.04 8.53 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 168.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -54.58 -37.12 90.64 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.056 1.837 . . . . 0.0 113.062 -168.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -61.6 -55.73 27.58 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.47 -36.51 76.54 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 C-N-CA 124.833 1.253 . . . . 0.0 109.93 -172.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.416 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 52.6 t80 -73.49 -37.58 65.68 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.836 -0.54 . . . . 0.0 111.315 -178.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -81.36 -16.17 53.09 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.805 -0.559 . . . . 0.0 110.936 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -73.3 -13.43 61.12 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.343 1.057 . . . . 0.0 110.762 169.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 69.2 mt -73.72 152.86 89.34 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.142 -0.974 . . . . 0.0 109.108 172.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -54.69 142.54 72.75 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.076 1.851 . . . . 0.0 110.611 172.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.63 -33.91 64.45 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.583 0.753 . . . . 0.0 112.098 -179.091 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -72.45 -30.51 64.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.341 -0.849 . . . . 0.0 113.205 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 64.4 t -69.0 -42.44 82.11 Favored 'Isoleucine or valine' 0 C--O 1.23 0.051 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 172.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.416 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 73.8 mt-30 -54.82 -49.87 69.97 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -54.39 -46.98 73.19 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 175.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.62 -40.25 95.15 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.625 0.648 . . . . 0.0 110.499 -177.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 699' ' ' LEU . . . . . 0.408 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 0.2 OUTLIER -62.86 -32.65 73.93 Favored 'General case' 0 C--N 1.332 -0.152 0 C-N-CA 124.224 1.01 . . . . 0.0 111.375 175.689 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 18.8 mt -65.7 -41.54 92.24 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 120.066 1.303 . . . . 0.0 110.261 170.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.78 -38.35 90.76 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.45 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -59.58 -55.3 36.25 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 119.103 0.865 . . . . 0.0 109.43 173.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 703' ' ' TRP . . . . . 0.408 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 20.1 m0 -71.62 4.87 2.77 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.214 -0.929 . . . . 0.0 112.638 177.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 704' ' ' LYS . . . . . 0.473 ' HZ2' ' C ' ' A' ' 707' ' ' GLY 0.266 1.2 tppm? -124.4 10.79 8.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.588 1.155 . . . . 0.0 112.617 169.064 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -122.51 4.99 9.59 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.815 1.246 . . . . 0.0 110.98 168.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 32.5 p -121.6 -6.91 9.17 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.453 1.501 . . . . 0.0 111.656 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 707' ' ' GLY . . . . . 0.473 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.245 0.831 0 N-CA-C 105.531 -3.028 . . . . 0.0 105.531 -176.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo . . . . . 0 CA--C 1.546 1.101 0 CA-C-O 120.769 0.237 . . . . 0.0 111.636 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 70.3 p -135.38 49.24 2.19 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.589 1.156 . . . . 0.0 109.248 -176.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.4 -58.39 0.13 Allowed 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.396 1.078 . . . . 0.0 109.383 -169.538 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 12.8 pt -69.93 128.97 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 123.565 0.746 . . . . 0.0 109.025 169.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -73.83 139.62 77.13 Favored Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 168.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.83 -37.09 97.66 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.698 2.266 . . . . 0.0 112.017 -174.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -68.88 -41.19 78.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.069 -0.491 . . . . 0.0 109.68 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 99.7 t -62.41 -40.74 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.466 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 84.5 t80 -62.45 -40.17 95.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 121.344 -0.847 . . . . 0.0 112.376 173.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -76.91 -10.86 59.65 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.488 -0.758 . . . . 0.0 111.998 -178.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -72.98 -21.27 60.87 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.502 1.047 . . . . 0.0 110.3 168.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 83.7 mt -61.25 151.16 77.24 Favored Pre-proline 0 CA--C 1.536 0.409 0 O-C-N 121.092 -1.005 . . . . 0.0 109.658 175.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -54.06 148.05 41.09 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 123.12 2.547 . . . . 0.0 110.981 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -34.06 -62.89 0.3 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 126.367 1.867 . . . . 0.0 111.331 176.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.48 -27.45 64.22 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -172.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 72.7 t -64.97 -45.62 94.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 174.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.466 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 60.1 mt-30 -56.84 -49.59 74.98 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -67.21 -33.04 74.52 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 116.93 -1.51 . . . . 0.0 111.893 -169.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -67.1 -50.5 61.38 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.244 1.384 . . . . 0.0 109.706 172.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -59.0 -38.74 79.9 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.396 0.998 . . . . 0.0 111.652 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 45.5 mt -67.99 -43.49 78.79 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.719 0.808 . . . . 0.0 109.994 176.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.25 -28.47 66.34 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.635 -0.698 . . . . 0.0 111.515 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -66.87 -61.35 2.0 Allowed 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 170.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.3 m0 -57.89 -20.55 37.66 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 117.339 -1.315 . . . . 0.0 112.071 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 4.2 mmpm? -89.28 -34.22 16.67 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 122.252 2.296 . . . . 0.0 112.794 169.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 7.5 ptp85 -65.64 -19.86 66.08 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 120.871 1.669 . . . . 0.0 110.744 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 24.3 p -106.38 21.33 17.58 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.788 1.235 . . . . 0.0 111.982 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 CA-C-O 118.358 -1.246 . . . . 0.0 110.258 175.023 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.271 0.0 OUTLIER . . . . . 0 N--CA 1.463 -0.305 0 N-CA-C 119.669 2.911 . . . . 0.0 119.669 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 59.1 m -160.91 -41.67 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 120.071 1.305 . . . . 0.0 110.463 172.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 19.2 p-10 -81.15 -61.54 1.92 Allowed 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.946 1.698 . . . . 0.0 109.217 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 3.4 pt -62.33 156.66 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 125.249 1.419 . . . . 0.0 111.605 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -137.94 165.85 30.56 Favored Pre-proline 0 C--N 1.329 -0.298 0 C-N-CA 126.803 2.041 . . . . 0.0 105.898 172.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -58.33 -36.32 97.76 Favored 'Trans proline' 0 CA--C 1.508 -0.775 0 C-N-CA 123.089 2.526 . . . . 0.0 113.795 -168.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -62.36 -54.7 36.55 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 17.8 t -60.08 -39.47 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.073 0 C-N-CA 124.981 1.312 . . . . 0.0 109.25 -174.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 68.7 t80 -70.52 -39.32 74.14 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.808 -177.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -82.84 -16.23 48.49 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.032 0.833 . . . . 0.0 111.234 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -71.24 -11.66 61.04 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.529 1.131 . . . . 0.0 110.656 168.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 53.6 mt -76.5 152.4 83.41 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 124.027 0.931 . . . . 0.0 109.284 171.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -56.2 146.99 68.44 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.944 2.429 . . . . 0.0 110.947 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -46.76 -49.91 18.99 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.075 0.95 . . . . 0.0 112.003 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.55 -28.28 67.66 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -177.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 81.8 t -69.48 -36.93 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 CA-C-N 118.747 0.703 . . . . 0.0 109.493 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 70.7 mt-30 -65.38 -46.45 80.05 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.231 1.015 . . . . 0.0 108.365 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -50.26 74.54 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.607 178.474 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.82 -39.52 90.94 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 123.32 0.648 . . . . 0.0 111.515 -175.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -40.81 95.67 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 121.283 -0.885 . . . . 0.0 109.81 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 40.3 mt -65.36 -41.14 94.12 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.085 0.857 . . . . 0.0 110.409 174.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.74 -40.7 93.4 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.963 -0.542 . . . . 0.0 110.446 175.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.28 -54.86 38.64 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.014 0.925 . . . . 0.0 108.824 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -67.46 0.8 2.7 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.347 1.059 . . . . 0.0 113.066 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -122.14 7.16 9.71 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.425 1.011 . . . . 0.0 113.19 169.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -118.4 13.28 13.54 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.563 1.145 . . . . 0.0 111.52 170.023 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 23.3 p -129.92 -7.12 4.46 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.235 1.414 . . . . 0.0 111.958 -176.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.947 0 N-CA-C 104.332 -3.507 . . . . 0.0 104.332 -169.866 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo . . . . . 0 N--CA 1.457 -0.656 0 CA-C-O 121.708 0.628 . . . . 0.0 113.668 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.3 m -44.13 -41.55 5.73 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.711 1.604 . . . . 0.0 114.847 -169.002 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -69.74 -81.37 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.289 2.236 . . . . 0.0 112.084 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.7 pt -53.08 114.14 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 C-N-CA 127.212 2.205 . . . . 0.0 112.842 -169.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.9 145.44 98.92 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 168.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -59.48 -31.63 94.99 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.075 1.85 . . . . 0.0 112.142 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -66.51 -45.87 78.1 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 45.0 t -59.96 -42.36 89.2 Favored 'Isoleucine or valine' 0 C--N 1.342 0.281 0 C-N-CA 123.642 0.777 . . . . 0.0 109.435 174.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -62.25 -39.64 93.52 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.544 -176.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -82.28 -16.09 50.68 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.19 0.904 . . . . 0.0 112.334 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -71.28 -23.3 61.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.497 0.719 . . . . 0.0 110.346 169.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 85.5 mt -58.69 147.17 72.05 Favored Pre-proline 0 CA--C 1.538 0.482 0 O-C-N 121.115 -0.991 . . . . 0.0 109.604 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -54.92 147.78 50.21 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.457 2.105 . . . . 0.0 110.476 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -49.46 -48.31 47.68 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.481 0.712 . . . . 0.0 111.466 -175.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.37 -26.24 64.57 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.707 1.002 . . . . 0.0 113.707 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 69.7 t -71.4 -37.97 66.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 118.889 0.768 . . . . 0.0 109.277 172.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.36 -47.45 79.27 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 122.565 1.174 . . . . 0.0 107.849 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.03 -46.35 91.06 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.276 -1.329 . . . . 0.0 109.893 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.79 -39.88 91.39 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 118.733 0.697 . . . . 0.0 111.138 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -40.23 96.58 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.198 0.908 . . . . 0.0 110.396 175.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 47.5 mt -66.9 -39.81 87.52 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.463 -0.773 . . . . 0.0 110.528 175.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.87 -38.45 91.15 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.606 0.639 . . . . 0.0 110.512 174.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -62.19 -54.57 39.09 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.694 1.197 . . . . 0.0 108.428 177.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.5 m0 -66.5 -6.6 15.43 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.246 -0.909 . . . . 0.0 113.225 176.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 704' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -108.96 1.56 20.75 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 117.979 -1.01 . . . . 0.0 113.06 169.735 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -117.92 -3.08 11.2 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.751 1.221 . . . . 0.0 112.661 169.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.7 p -116.16 -8.12 11.79 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.578 1.551 . . . . 0.0 110.973 174.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.458 0 C-N-CA 130.099 3.714 . . . . 0.0 104.091 169.624 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo . . . . . 0 CA--C 1.533 0.432 0 N-CA-C 115.853 1.444 . . . . 0.0 115.853 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 29.0 m 115.11 -6.35 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 130.971 3.709 . . . . 0.0 109.916 -170.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -68.7 -13.72 62.55 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.507 1.923 . . . . 0.0 111.019 168.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 683' ' ' ILE . . . . . 0.425 HD12 ' CD1' ' A' ' 688' ' ' PHE . 10.1 pt -135.2 146.57 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.992 0 C-N-CA 127.258 2.223 . . . . 0.0 109.342 -176.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -91.23 143.89 29.02 Favored Pre-proline 0 CA--C 1.541 0.615 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 167.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -57.62 -40.38 80.51 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.718 2.279 . . . . 0.0 112.561 -174.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -68.35 -43.85 76.53 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.38 -40.52 88.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 84.2 t80 -58.66 -38.64 78.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 121.681 -0.637 . . . . 0.0 112.096 176.574 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -80.68 -15.91 55.34 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.858 0.754 . . . . 0.0 112.727 -179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -73.36 -19.97 60.88 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.333 0.97 . . . . 0.0 110.813 169.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.77 148.82 66.82 Favored Pre-proline 0 CA--C 1.536 0.411 0 O-C-N 120.905 -1.122 . . . . 0.0 109.463 172.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -54.34 147.29 46.99 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 122.483 2.122 . . . . 0.0 110.576 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 693' ' ' GLU . . . . . 0.431 ' CD ' ' HZ3' ' A' ' 697' ' ' LYS . 45.1 tp10 -38.11 -58.56 0.95 Allowed 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 125.461 1.504 . . . . 0.0 110.945 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.83 -25.09 62.68 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -173.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.41 -43.47 87.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 119.351 0.978 . . . . 0.0 108.595 173.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.458 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 66.7 mt-30 -57.49 -45.5 84.83 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 697' ' ' LYS . . . . . 0.431 ' HZ3' ' CD ' ' A' ' 693' ' ' GLU . 11.5 mptt -71.78 -33.89 68.98 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.529 -174.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -66.63 -46.45 75.79 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.324 1.05 . . . . 0.0 111.213 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.63 -43.08 99.52 Favored 'General case' 0 N--CA 1.461 0.097 0 O-C-N 121.412 -0.805 . . . . 0.0 110.168 177.198 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.01 -41.07 91.33 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.928 -0.482 . . . . 0.0 111.008 172.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -59.48 -48.14 82.79 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 117.666 -1.159 . . . . 0.0 109.806 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -62.05 -45.63 92.72 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 120.348 1.431 . . . . 0.0 111.449 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 31.1 m0 -63.62 -14.13 48.74 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 120.501 -1.374 . . . . 0.0 112.506 175.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 704' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.6 OUTLIER -101.74 -17.85 16.08 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.726 1.211 . . . . 0.0 112.928 169.56 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -67.77 -41.29 83.5 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 121.412 1.915 . . . . 0.0 109.033 171.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 17.7 p -73.38 24.33 0.07 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.913 2.085 . . . . 0.0 113.539 -172.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 -172.26 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.279 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.42 0 N-CA-C 118.664 2.524 . . . . 0.0 118.664 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 69.0 m -158.76 -39.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.785 1.175 . . . . 0.0 110.507 177.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 682' ' ' ASP . . . . . 0.447 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 19.0 p-10 -75.75 -74.22 0.23 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.541 1.536 . . . . 0.0 108.688 171.223 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 683' ' ' ILE . . . . . 0.447 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 6.2 pt -58.44 156.53 2.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 C-N-CA 126.422 1.889 . . . . 0.0 111.681 -176.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -141.68 169.9 10.28 Favored Pre-proline 0 C--N 1.331 -0.201 0 C-N-CA 125.786 1.634 . . . . 0.0 106.806 169.59 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -55.29 -36.2 93.06 Favored 'Trans proline' 0 CA--C 1.506 -0.905 0 C-N-CA 122.567 2.178 . . . . 0.0 113.81 -168.64 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -63.14 -56.08 19.81 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 11.9 t -61.78 -37.39 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 C-N-CA 124.305 1.042 . . . . 0.0 109.546 -173.414 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 75.8 t80 -75.32 -40.83 58.02 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 123.345 0.658 . . . . 0.0 111.341 -176.257 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -82.05 -14.1 56.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.059 0.845 . . . . 0.0 110.934 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -74.36 -9.67 58.83 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.834 1.254 . . . . 0.0 110.325 168.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 54.3 mt -76.34 152.92 83.96 Favored Pre-proline 0 CA--C 1.534 0.339 0 O-C-N 121.499 -0.751 . . . . 0.0 109.144 170.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -55.6 146.7 63.23 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.755 2.303 . . . . 0.0 110.653 177.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -46.39 -49.81 17.44 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 124.249 1.02 . . . . 0.0 111.943 -176.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.46 -28.12 66.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.316 -0.85 . . . . 0.0 113.237 -177.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 90.6 t -68.93 -38.05 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 118.922 0.783 . . . . 0.0 109.406 172.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.43 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 72.8 mt-30 -63.99 -47.7 79.33 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 -178.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.58 -46.54 89.85 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.08 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -62.66 -43.11 99.64 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.11 0.964 . . . . 0.0 111.63 -178.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.0 -39.27 90.16 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.385 0.674 . . . . 0.0 110.247 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 36.0 mt -63.4 -41.37 98.75 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 118.909 0.777 . . . . 0.0 110.243 172.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.75 97.78 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.958 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -61.35 -47.09 87.49 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 119.371 0.987 . . . . 0.0 110.825 177.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 25.0 m0 -68.93 0.05 4.96 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.315 -0.866 . . . . 0.0 112.618 173.197 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 704' ' ' LYS . . . . . 0.513 ' HZ2' ' C ' ' A' ' 707' ' ' GLY . 1.2 tppm? -117.56 3.66 12.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.358 1.463 . . . . 0.0 112.175 168.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -95.17 -11.4 28.17 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.911 1.285 . . . . 0.0 109.53 168.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 17.1 p -122.58 -3.68 8.79 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.565 1.146 . . . . 0.0 113.69 -168.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 707' ' ' GLY . . . . . 0.513 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.251 1.162 0 N-CA-C 106.158 -2.777 . . . . 0.0 106.158 -175.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo . . . . . 0 CA--C 1.537 0.634 0 N-CA-C 113.642 0.593 . . . . 0.0 113.642 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . 0.258 26.6 m 76.06 8.0 3.54 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 127.152 2.181 . . . . 0.0 113.291 174.078 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -74.76 -40.05 61.43 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 167.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 14.1 pt -76.0 127.22 37.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 127.204 2.202 . . . . 0.0 107.92 168.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -72.49 141.6 83.08 Favored Pre-proline 0 CA--C 1.543 0.677 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 167.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.84 -37.47 96.2 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.499 2.133 . . . . 0.0 112.057 -173.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -69.26 -42.75 75.15 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 64.9 t -59.75 -40.15 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 C-N-CA 123.359 0.664 . . . . 0.0 109.455 176.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.442 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 74.4 t80 -62.7 -42.41 99.63 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.378 -0.826 . . . . 0.0 112.016 176.252 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -75.96 -12.03 60.07 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.941 0.791 . . . . 0.0 112.182 -178.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -73.43 -20.75 60.64 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.446 1.021 . . . . 0.0 110.12 168.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 87.3 mt -60.07 151.04 67.84 Favored Pre-proline 0 CA--C 1.536 0.439 0 O-C-N 120.885 -1.134 . . . . 0.0 109.205 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -54.93 148.06 48.93 Favored 'Trans proline' 0 N--CA 1.452 -0.935 0 C-N-CA 122.607 2.205 . . . . 0.0 110.446 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 693' ' ' GLU . . . . . 0.459 ' CD ' ' HZ3' ' A' ' 697' ' ' LYS . 45.8 tp10 -41.32 -57.47 2.13 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.055 1.342 . . . . 0.0 111.262 -179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.8 -27.96 66.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -174.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 98.9 t -67.76 -45.1 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 176.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.442 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 70.0 mt-30 -55.36 -44.5 76.06 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 122.024 0.916 . . . . 0.0 109.318 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 697' ' ' LYS . . . . . 0.459 ' HZ3' ' CD ' ' A' ' 693' ' ' GLU . 9.1 mptt -69.87 -41.37 74.9 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 117.622 -1.18 . . . . 0.0 110.347 -171.428 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -69.9 -43.77 71.07 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 119.614 1.097 . . . . 0.0 111.022 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -56.39 -46.56 80.06 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.877 0.762 . . . . 0.0 110.941 174.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 32.2 mt -69.03 -33.97 74.47 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.472 -0.767 . . . . 0.0 111.461 178.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.99 -34.74 73.74 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 119.257 0.935 . . . . 0.0 110.903 176.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -67.73 -51.81 44.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.349 1.06 . . . . 0.0 109.007 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -59.94 -34.09 72.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 120.965 -1.084 . . . . 0.0 110.9 176.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 704' ' ' LYS . . . . . 0.465 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.3 OUTLIER -74.99 -35.63 62.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 117.666 -1.159 . . . . 0.0 112.777 175.173 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -74.71 -14.02 60.68 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 120.877 1.671 . . . . 0.0 111.899 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 36.0 p -103.7 18.94 20.82 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.279 1.032 . . . . 0.0 111.938 -178.219 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.856 0 CA-C-O 117.188 -1.895 . . . . 0.0 108.724 179.098 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo . . . . . 0 CA--C 1.539 0.744 0 N-CA-C 116.127 1.549 . . . . 0.0 116.127 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.8 m -49.68 -29.87 8.14 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.732 1.613 . . . . 0.0 115.121 -169.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -90.15 -68.5 0.78 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.664 1.586 . . . . 0.0 110.789 177.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.5 pt -66.61 162.1 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 125.877 1.671 . . . . 0.0 113.083 -171.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -140.84 166.29 23.81 Favored Pre-proline 0 N--CA 1.468 0.467 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 169.684 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -56.9 -34.67 97.57 Favored 'Trans proline' 0 CA--C 1.505 -0.958 0 C-N-CA 122.533 2.156 . . . . 0.0 113.666 -168.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -63.38 -55.71 22.19 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -178.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 17.6 t -65.93 -34.46 70.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 124.218 1.007 . . . . 0.0 109.431 -173.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.431 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 79.5 t80 -70.74 -41.74 71.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 121.893 -0.504 . . . . 0.0 111.495 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -82.63 -13.75 55.93 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.232 0.924 . . . . 0.0 111.015 -179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -71.59 -17.17 62.3 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.36 1.064 . . . . 0.0 109.954 168.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 70.4 mt -66.55 152.51 94.83 Favored Pre-proline 0 C--N 1.344 0.364 0 O-C-N 121.199 -0.938 . . . . 0.0 109.765 174.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -55.06 147.12 54.92 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.023 2.482 . . . . 0.0 110.252 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -46.62 -50.74 17.11 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 124.181 0.993 . . . . 0.0 112.436 -172.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.0 93.35 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 57.8 t -61.23 -38.09 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 O-C-N 121.357 -0.839 . . . . 0.0 109.531 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.431 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 60.8 mt-30 -64.0 -48.12 77.65 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.222 0.465 . . . . 0.0 110.468 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.6 -48.53 80.52 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -176.562 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.51 -37.03 76.99 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 122.736 0.414 . . . . 0.0 110.344 -173.406 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.55 -42.53 91.75 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.829 0.741 . . . . 0.0 110.192 175.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.03 -40.68 94.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.796 0.725 . . . . 0.0 110.711 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.59 -38.23 70.89 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.57 0.623 . . . . 0.0 111.912 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 39.8 tp10 -69.42 -41.65 76.07 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.43 1.092 . . . . 0.0 110.099 -179.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -61.31 -45.33 94.91 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.185 -0.947 . . . . 0.0 109.087 170.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.5 tptp -60.83 -24.51 65.93 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.504 1.047 . . . . 0.0 112.96 176.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -73.01 -11.73 60.67 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.307 1.043 . . . . 0.0 112.166 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.57 -13.46 1.99 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -168.548 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.848 0 N-CA-C 105.072 -3.211 . . . . 0.0 105.072 170.188 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo . . . . . 0 CA--C 1.534 0.489 0 N-CA-C 113.441 0.516 . . . . 0.0 113.441 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 15.2 m 67.27 15.45 9.97 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.88 1.672 . . . . 0.0 113.692 173.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -76.76 -41.09 46.15 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.605 1.562 . . . . 0.0 107.577 168.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.1 pt -81.89 139.2 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 C-N-CA 128.021 2.528 . . . . 0.0 108.301 169.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -73.57 144.2 83.2 Favored Pre-proline 0 CA--C 1.542 0.66 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 168.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -60.66 -38.07 74.66 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 121.727 1.618 . . . . 0.0 111.526 -175.19 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -63.62 -47.39 81.61 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 58.4 t -61.71 -37.12 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -176.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 86.5 t80 -62.83 -47.49 83.2 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.389 -0.82 . . . . 0.0 112.235 171.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -74.22 -14.22 60.9 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.204 -0.935 . . . . 0.0 111.701 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -73.82 -14.54 61.11 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.676 1.19 . . . . 0.0 110.646 169.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 77.3 mt -64.77 152.74 89.64 Favored Pre-proline 0 CA--C 1.537 0.445 0 O-C-N 121.022 -1.049 . . . . 0.0 109.697 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -55.3 144.07 73.17 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.139 2.559 . . . . 0.0 109.945 177.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -44.94 -50.09 10.71 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.613 1.165 . . . . 0.0 112.079 -174.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.46 -32.3 73.05 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 97.4 t -67.11 -40.1 84.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 176.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.43 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 74.0 mt-30 -62.54 -48.67 78.51 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 -177.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -45.04 79.53 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.114 -175.13 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -67.5 -43.18 81.52 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.02 0.827 . . . . 0.0 111.598 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 699' ' ' LEU . . . . . 0.411 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 2.0 mm? -63.06 -35.98 82.07 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 120.988 -1.07 . . . . 0.0 112.249 174.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 39.9 mt -69.7 -38.2 76.88 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 177.043 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.48 -36.84 83.76 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.684 -0.674 . . . . 0.0 110.352 173.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -63.8 -54.08 40.8 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.528 1.131 . . . . 0.0 109.456 176.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 703' ' ' TRP . . . . . 0.411 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 31.3 m0 -62.36 -25.34 67.86 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 120.846 -1.159 . . . . 0.0 111.587 177.811 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 704' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.5 OUTLIER -81.39 -32.81 32.66 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 117.177 -1.392 . . . . 0.0 112.766 173.28 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -82.34 -27.51 32.16 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.977 1.717 . . . . 0.0 111.432 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 27.9 p -86.72 155.36 20.39 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.028 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.91 0 N-CA-C 107.422 -2.271 . . . . 0.0 107.422 168.867 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo . . . . . 0 CA--C 1.535 0.536 0 N-CA-C 116.446 1.671 . . . . 0.0 116.446 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 5.8 m -45.62 -35.78 4.3 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 126.604 1.962 . . . . 0.0 115.849 -169.521 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -81.26 -61.98 1.79 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.621 1.1 . . . . 0.0 110.494 174.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.23 168.34 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 125.247 2.451 . . . . 0.0 114.512 -169.591 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -146.56 148.95 35.52 Favored Pre-proline 0 C--N 1.322 -0.613 0 C-N-CA 129.288 3.035 . . . . 0.0 104.551 -173.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -59.97 -33.63 95.51 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 CA-C-N 121.892 1.712 . . . . 0.0 112.516 -174.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -63.61 -50.45 69.32 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 109.074 -0.714 . . . . 0.0 109.074 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 29.9 t -64.51 -38.61 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 C-N-CA 123.674 0.79 . . . . 0.0 109.086 -178.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -68.07 -40.93 82.6 Favored 'General case' 0 N--CA 1.444 -0.762 0 O-C-N 121.632 -0.667 . . . . 0.0 111.658 -177.371 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -81.57 -14.48 56.76 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.989 0.813 . . . . 0.0 111.811 -179.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -67.91 -24.67 65.23 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.671 0.789 . . . . 0.0 109.747 169.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 55.6 mt -63.28 148.53 93.09 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 121.604 -0.685 . . . . 0.0 109.546 173.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -55.62 147.87 57.18 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.726 2.284 . . . . 0.0 110.691 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -47.59 -49.71 26.01 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.879 0.872 . . . . 0.0 111.718 -175.443 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.54 -27.24 66.8 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -177.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 97.0 t -71.66 -36.74 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 118.826 0.739 . . . . 0.0 109.386 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -65.0 -44.83 87.93 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 122.248 1.023 . . . . 0.0 108.493 -178.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.13 -50.74 70.69 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.184 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -65.18 -38.34 90.2 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 122.955 0.502 . . . . 0.0 111.421 -176.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.85 -42.29 95.01 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 119.986 1.266 . . . . 0.0 110.083 177.382 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.95 -36.5 84.18 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.329 0.513 . . . . 0.0 110.832 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.26 -37.75 71.93 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.379 0.672 . . . . 0.0 111.123 176.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.91 -50.95 62.62 Favored 'General case' 0 CA--C 1.516 -0.343 0 C-N-CA 125.037 1.335 . . . . 0.0 108.65 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -57.51 -48.25 79.76 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 121.561 -0.712 . . . . 0.0 109.151 174.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.6 tpmp? -69.12 -11.0 60.4 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 117.329 -1.319 . . . . 0.0 113.928 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -105.09 6.06 32.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 121.45 1.932 . . . . 0.0 111.839 173.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 34.8 p -125.66 -17.17 5.55 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.028 0.931 . . . . 0.0 111.861 176.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 N-CA-C 106.856 -2.497 . . . . 0.0 106.856 169.991 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo . . . . . 0 CA--C 1.535 0.552 0 N-CA-C 110.846 -0.482 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 16.9 m 46.78 24.79 0.37 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.066 1.347 . . . . 0.0 112.92 -170.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . 0.374 12.2 t0 32.25 41.0 0.02 OUTLIER 'General case' 0 C--O 1.233 0.234 0 C-N-CA 129.537 3.135 . . . . 0.0 116.114 -169.076 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 4.5 pt -53.13 148.62 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 122.797 1.284 . . . . 0.0 109.343 169.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -70.84 135.9 85.44 Favored Pre-proline 0 N--CA 1.444 -0.729 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 170.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -55.19 -36.69 93.83 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.854 1.703 . . . . 0.0 111.452 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -64.94 -44.5 89.28 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -176.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 51.4 t -69.06 -42.58 82.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -56.56 -45.11 81.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.157 -0.964 . . . . 0.0 113.444 173.037 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -84.93 -5.75 59.34 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 118.763 0.71 . . . . 0.0 111.587 -174.336 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -77.04 -22.38 53.05 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.783 1.233 . . . . 0.0 109.252 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 91.3 mt -58.98 150.55 60.44 Favored Pre-proline 0 CA--C 1.534 0.346 0 O-C-N 121.389 -0.82 . . . . 0.0 109.968 175.052 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -53.49 147.63 37.42 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 123.253 2.635 . . . . 0.0 110.631 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -48.73 -48.59 40.45 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.602 0.761 . . . . 0.0 111.428 -174.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.85 -25.79 63.9 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -178.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 89.3 t -70.9 -43.77 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 119.288 0.949 . . . . 0.0 108.858 172.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -58.52 -47.26 84.73 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.66 0.664 . . . . 0.0 109.314 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.72 -43.26 97.06 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 117.973 -1.013 . . . . 0.0 109.904 -179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -66.8 -39.14 87.64 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 119.255 0.934 . . . . 0.0 111.038 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -42.87 96.2 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 121.409 -0.807 . . . . 0.0 109.467 176.22 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 32.2 mt -63.79 -40.97 97.94 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.967 0.803 . . . . 0.0 110.911 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -62.52 -40.92 98.32 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.726 -0.655 . . . . 0.0 110.337 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -60.13 -54.46 45.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 26.9 m0 -66.99 0.23 2.69 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.524 1.13 . . . . 0.0 113.261 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 704' ' ' LYS . . . . . 0.504 ' HZ2' ' C ' ' A' ' 707' ' ' GLY . 1.2 tppm? -125.55 10.91 7.91 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.786 -1.196 . . . . 0.0 113.63 169.466 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -117.99 13.91 14.03 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.714 1.206 . . . . 0.0 110.542 169.212 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 24.7 p -131.92 -7.41 3.52 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.148 1.779 . . . . 0.0 111.518 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 707' ' ' GLY . . . . . 0.504 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.253 1.289 0 N-CA-C 104.665 -3.374 . . . . 0.0 104.665 -169.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo . . . . . 0 CA--C 1.542 0.894 0 CA-C-O 121.664 0.61 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 14.4 m -148.58 17.73 1.03 Allowed 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.413 -1.429 . . . . 0.0 111.736 176.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -87.71 -38.66 15.63 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.375 1.47 . . . . 0.0 109.219 169.111 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 12.9 pt -83.9 145.26 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 C-N-CA 124.845 1.258 . . . . 0.0 110.669 170.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -84.3 142.59 40.92 Favored Pre-proline 0 CA--C 1.541 0.632 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 168.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -74.77 -29.0 9.13 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 CA-C-N 120.286 1.138 . . . . 0.0 111.064 -171.047 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -69.14 -43.76 73.71 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 119.481 1.037 . . . . 0.0 109.09 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 92.2 t -56.58 -44.82 81.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 174.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.403 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 90.7 t80 -59.58 -43.14 93.72 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 175.403 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -78.13 -13.08 60.0 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.761 1.164 . . . . 0.0 112.367 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -82.09 -7.01 59.6 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.019 0.928 . . . . 0.0 110.933 168.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 71.8 mt -65.61 152.91 91.75 Favored Pre-proline 0 CA--C 1.534 0.354 0 O-C-N 121.036 -1.04 . . . . 0.0 109.083 169.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -55.2 145.99 62.5 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.074 2.516 . . . . 0.0 110.511 178.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 32.3 tp10 -46.21 -50.18 16.16 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.267 1.027 . . . . 0.0 112.09 -174.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.88 -29.47 67.77 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -177.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 94.2 t -68.04 -41.34 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.403 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.3 mt-30 -63.31 -46.68 85.55 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 -177.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -40.9 85.74 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 117.393 -1.289 . . . . 0.0 110.57 -175.312 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -69.8 -43.69 71.56 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 119.921 1.237 . . . . 0.0 111.146 179.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 699' ' ' LEU . . . . . 0.456 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 1.5 mm? -61.76 -42.87 99.55 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 121.132 -0.98 . . . . 0.0 111.041 177.345 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 27.5 mt -64.69 -39.52 93.81 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.394 0.543 . . . . 0.0 110.696 176.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -56.38 -55.97 26.94 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-O 115.968 -1.968 . . . . 0.0 108.537 170.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -49.32 -49.16 45.22 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 122.558 2.436 . . . . 0.0 110.122 175.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 703' ' ' TRP . . . . . 0.456 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 44.4 m0 -70.56 -4.51 23.4 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -175.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 1.7 tppm? -135.67 -5.97 2.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 121.148 1.795 . . . . 0.0 115.029 169.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -77.19 -37.51 53.42 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 127.184 2.194 . . . . 0.0 109.095 170.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.52 61.34 0.72 Allowed 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 -168.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.039 0 N-CA-C 109.364 -1.494 . . . . 0.0 109.364 -169.619 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo . . . . . 0 N--CA 1.46 -0.468 0 CA-C-O 118.407 -0.747 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 19.3 m 116.93 16.57 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 131.528 3.931 . . . . 0.0 110.39 -178.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -114.97 -37.94 4.03 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.761 1.624 . . . . 0.0 112.808 -169.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.3 pt -92.1 138.65 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.723 1.209 . . . . 0.0 111.617 -173.303 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -65.69 138.75 96.77 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 168.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.61 -28.12 10.2 Favored 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 121.278 1.319 . . . . 0.0 111.165 -169.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 23.6 mm100 -69.1 -46.77 66.91 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 119.484 1.038 . . . . 0.0 108.436 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 89.3 t -57.99 -36.03 54.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.339 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 688' ' ' PHE . . . . . 0.409 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 73.0 t80 -68.89 -53.04 23.4 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 119.363 0.983 . . . . 0.0 113.608 169.755 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -75.87 -10.64 59.6 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.968 -1.082 . . . . 0.0 112.954 -169.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -83.91 -1.87 55.37 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.808 1.243 . . . . 0.0 111.196 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 58.7 mt -70.59 156.65 91.63 Favored Pre-proline 0 CA--C 1.535 0.397 0 O-C-N 120.859 -1.151 . . . . 0.0 109.415 169.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -56.33 142.77 87.92 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.251 2.634 . . . . 0.0 110.696 177.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.02 -36.06 67.54 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.688 0.795 . . . . 0.0 112.948 -172.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.96 -33.27 70.29 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.297 -0.877 . . . . 0.0 113.093 175.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 75.5 t -65.11 -43.34 95.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 173.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.409 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.4 mt-30 -56.48 -53.12 61.21 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -53.45 -41.36 66.06 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 118.089 -0.958 . . . . 0.0 113.03 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -42.31 84.37 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.75 0.705 . . . . 0.0 110.193 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -66.08 -36.21 82.59 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 120.999 -1.063 . . . . 0.0 112.569 174.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.56 -44.51 96.08 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.711 1.141 . . . . 0.0 108.753 172.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.99 96.55 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.511 177.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.13 -46.17 90.54 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 119.937 1.244 . . . . 0.0 110.437 177.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 38.9 m0 -64.72 -14.1 57.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 120.653 -1.28 . . . . 0.0 112.099 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 704' ' ' LYS . . . . . 0.489 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.5 OUTLIER -103.64 -17.33 15.19 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 117.749 -1.119 . . . . 0.0 112.51 168.795 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 80.7 mtm-85 -69.72 -40.68 76.09 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 121.41 1.914 . . . . 0.0 109.244 169.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 20.7 p -77.21 29.79 0.14 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.075 1.75 . . . . 0.0 113.244 -169.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.642 0 N-CA-C 108.763 -1.735 . . . . 0.0 108.763 -170.6 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.527 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -147.55 146.42 29.43 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 12.7 ptm 46.09 17.91 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.708 2.003 . . . . 0.0 114.709 -169.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -152.35 152.56 29.45 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 128.337 2.655 . . . . 0.0 105.641 -174.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.264 0.0 OUTLIER -11.46 -88.07 0.0 OUTLIER 'Trans proline' 0 C--N 1.351 0.706 1 C-N-CA 127.347 5.364 . . . . 0.0 118.91 -176.584 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 67.6 m -160.17 -40.27 0.05 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.751 1.159 . . . . 0.0 110.815 177.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -77.55 -63.09 1.46 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.318 1.447 . . . . 0.0 109.343 176.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 1.4 pt -61.71 116.91 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 C-N-CA 125.49 1.516 . . . . 0.0 110.728 -172.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.53 157.83 63.97 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 168.291 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -56.72 -42.56 63.69 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.573 2.182 . . . . 0.0 111.093 -169.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -63.86 -43.53 95.81 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 123.728 0.642 . . . . 0.0 110.003 -176.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 15.6 t -65.94 -36.89 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.752 0.821 . . . . 0.0 109.785 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -64.37 -37.9 89.13 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.429 -0.794 . . . . 0.0 111.19 174.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -81.47 -14.38 57.08 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 118.933 0.788 . . . . 0.0 112.658 -178.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -73.63 -16.16 61.24 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.991 1.317 . . . . 0.0 110.723 169.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 81.1 mt -66.97 150.82 97.67 Favored Pre-proline 0 CA--C 1.533 0.306 0 O-C-N 121.521 -0.737 . . . . 0.0 109.186 171.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -54.97 142.46 76.16 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.372 2.048 . . . . 0.0 110.33 173.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.89 -35.68 61.87 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.984 0.914 . . . . 0.0 112.178 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -72.47 -28.66 63.05 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 61.2 t -70.68 -37.46 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 172.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -62.26 -50.37 72.01 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -176.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -49.18 -48.24 45.31 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.79 1.236 . . . . 0.0 113.363 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -41.74 96.33 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 118.527 0.603 . . . . 0.0 110.412 -179.334 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.98 -32.52 73.88 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.151 -0.968 . . . . 0.0 111.948 175.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.34 -40.35 97.05 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 119.734 1.152 . . . . 0.0 109.885 171.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.12 -34.32 70.95 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.257 176.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.39 -51.71 61.84 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 124.377 1.071 . . . . 0.0 109.598 176.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 21.2 m0 -59.94 -46.31 89.81 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 175.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.6 tptp -69.16 -11.35 60.72 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 120.357 1.435 . . . . 0.0 113.771 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -104.14 5.0 34.73 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 121.417 1.917 . . . . 0.0 111.821 172.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 29.5 p -124.42 -14.96 6.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.56 0.744 . . . . 0.0 112.202 174.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 N-CA-C 106.9 -2.48 . . . . 0.0 106.9 170.352 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.251 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -66.76 143.41 56.94 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 118.473 1.136 . . . . 0.0 110.336 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 12.6 ttp 54.88 8.46 0.23 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.067 2.147 . . . . 0.0 116.492 169.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -149.08 173.48 4.19 Favored Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 125.659 1.584 . . . . 0.0 107.171 -170.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -43.5 157.86 0.11 Allowed 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 122.491 2.127 . . . . 0.0 113.613 168.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 2.3 m -48.82 -37.84 20.47 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.446 1.498 . . . . 0.0 114.331 -169.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -79.75 -70.34 0.52 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.503 1.521 . . . . 0.0 110.887 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 1.5 pt -62.04 117.25 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 C-N-CA 125.739 1.615 . . . . 0.0 110.846 -170.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.14 160.43 62.9 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 169.149 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -58.96 -38.29 88.88 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.419 2.079 . . . . 0.0 111.563 -174.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -56.92 -54.62 44.49 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 124.011 0.819 . . . . 0.0 110.019 175.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 11.2 t -65.33 -33.59 64.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 C-N-CA 123.015 0.526 . . . . 0.0 109.618 -174.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.427 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 75.7 t80 -68.44 -39.42 81.53 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.985 -0.447 . . . . 0.0 112.139 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -84.34 -16.94 41.12 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.904 0.774 . . . . 0.0 111.653 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -71.81 -13.93 61.83 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.687 1.195 . . . . 0.0 110.41 169.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.02 151.97 96.55 Favored Pre-proline 0 CA--C 1.536 0.408 0 O-C-N 121.436 -0.79 . . . . 0.0 109.349 169.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -55.03 144.12 70.24 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.421 2.08 . . . . 0.0 110.091 175.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -30.87 -63.84 0.14 Allowed 'General case' 0 C--O 1.232 0.146 0 C-N-CA 126.922 2.089 . . . . 0.0 111.328 175.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.58 -23.94 64.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -172.025 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 80.6 t -69.48 -36.25 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 119.17 0.895 . . . . 0.0 109.374 173.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.427 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 59.6 mt-30 -65.93 -46.32 78.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -67.83 -41.92 82.27 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 114.381 -1.281 . . . . 0.0 109.325 -175.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -65.63 -41.36 92.75 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 119.094 -0.479 . . . . 0.0 110.884 176.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -36.29 83.9 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 119.563 1.074 . . . . 0.0 110.696 177.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 44.6 mt -67.42 -41.54 84.68 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.835 0.743 . . . . 0.0 110.204 174.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.46 -37.13 86.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.281 0.491 . . . . 0.0 110.672 173.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -63.88 -55.19 24.59 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.654 1.182 . . . . 0.0 108.315 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -65.85 -7.84 18.59 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.329 -0.857 . . . . 0.0 112.877 175.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 704' ' ' LYS . . . . . 0.498 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -107.74 2.5 23.74 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.324 169.915 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -119.34 -2.72 10.57 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.667 1.187 . . . . 0.0 112.364 169.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.9 p -115.84 -7.35 12.05 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.48 1.512 . . . . 0.0 110.962 173.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.882 0 C-N-CA 130.217 3.77 . . . . 0.0 104.072 169.567 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.581 0 N-CA-C 109.671 -1.371 . . . . 0.0 109.671 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -149.04 117.53 6.53 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 26.6 ptt? 41.47 42.57 1.95 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.495 1.918 . . . . 0.0 115.616 169.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 679' ' ' PHE . . . . . 0.4 ' CD2' ' HD2' ' A' ' 680' ' ' PRO . 2.9 t80 -139.35 160.42 62.01 Favored Pre-proline 0 CA--C 1.536 0.442 0 O-C-N 121.439 -0.788 . . . . 0.0 109.156 -176.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.4 ' HD2' ' CD2' ' A' ' 679' ' ' PHE . 77.4 Cg_exo -40.65 149.7 0.15 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 124.502 3.468 . . . . 0.0 113.091 168.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 11.2 m 46.99 26.39 0.59 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.481 1.512 . . . . 0.0 114.779 169.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . 0.267 23.5 t0 51.99 32.63 10.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.719 2.008 . . . . 0.0 114.471 -174.126 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 683' ' ' ILE . . . . . 0.401 HG21 HD13 ' A' ' 683' ' ' ILE . 22.9 mt -70.52 173.61 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 168.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.41 147.47 37.1 Favored Pre-proline 0 C--N 1.321 -0.646 0 N-CA-C 105.836 -1.912 . . . . 0.0 105.836 169.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -65.33 -34.91 42.61 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 CA-C-N 120.775 1.313 . . . . 0.0 111.549 -169.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -65.61 -48.65 71.54 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 176.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 49.4 t -55.05 -33.71 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 123.5 0.72 . . . . 0.0 110.224 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 65.6 t80 -75.52 -47.99 24.5 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 178.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -78.56 -11.95 59.99 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.032 -1.043 . . . . 0.0 111.728 -175.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -70.53 -20.47 62.81 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.085 1.354 . . . . 0.0 109.751 168.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 73.3 mt -65.6 151.52 94.41 Favored Pre-proline 0 CA--C 1.533 0.297 0 O-C-N 121.393 -0.817 . . . . 0.0 109.47 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_exo -54.39 146.88 49.37 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.222 2.615 . . . . 0.0 110.031 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.3 tp10 -47.63 -49.5 26.98 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.553 0.741 . . . . 0.0 112.021 -173.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -66.78 -30.45 70.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 93.3 t -68.14 -39.3 81.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 175.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.417 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 73.6 mt-30 -64.07 -45.13 90.14 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 122.315 1.055 . . . . 0.0 108.214 -178.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.08 -52.42 65.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.42 -1.263 . . . . 0.0 109.917 -178.804 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -64.64 -36.74 85.23 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 118.941 0.791 . . . . 0.0 111.599 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -38.61 86.18 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.018 0.826 . . . . 0.0 110.33 177.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 31.0 mt -68.49 -38.07 80.66 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 119.546 1.066 . . . . 0.0 110.42 174.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.49 -38.84 92.69 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.685 0.675 . . . . 0.0 110.242 173.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.27 -55.33 33.18 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 124.164 0.985 . . . . 0.0 108.775 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -67.16 -6.22 16.88 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.088 -1.007 . . . . 0.0 112.841 177.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 704' ' ' LYS . . . . . 0.501 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -110.3 3.01 19.5 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.402 1.001 . . . . 0.0 112.903 170.321 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -117.96 -9.55 10.57 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.528 1.131 . . . . 0.0 112.319 169.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.5 p -108.87 -5.68 16.09 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.465 1.506 . . . . 0.0 111.518 173.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.271 0 N-CA-C 104.32 -3.512 . . . . 0.0 104.32 169.461 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.523 0 N-CA-C 107.263 -2.335 . . . . 0.0 107.263 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -2' ' ' HIS . . . . . 0.446 ' CG ' ' H ' ' A' ' -1' ' ' MET . 43.6 t60 62.39 169.17 0.13 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.65 1.58 . . . . 0.0 110.182 -168.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' -1' ' ' MET . . . . . 0.446 ' H ' ' CG ' ' A' ' -2' ' ' HIS . 7.3 tpt -49.67 -30.65 9.47 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 126.851 2.06 . . . . 0.0 115.392 -169.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -155.68 127.78 3.94 Favored Pre-proline 0 CA--C 1.538 0.492 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 169.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -66.29 -152.96 0.02 OUTLIER 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 125.285 3.99 . . . . 0.0 112.243 168.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 12.9 m -145.64 9.0 1.17 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.191 -1.568 . . . . 0.0 112.942 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -77.37 -0.65 26.5 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.704 1.602 . . . . 0.0 111.933 169.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 8.8 pt -145.05 163.14 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 C-N-CA 127.436 2.294 . . . . 0.0 108.479 -172.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.75 150.42 37.71 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 125.331 1.452 . . . . 0.0 107.207 170.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -66.53 -37.48 22.38 Favored 'Trans proline' 0 N--CA 1.452 -0.957 0 C-N-CA 123.0 2.466 . . . . 0.0 113.413 -173.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 19.5 mm100 -68.25 -46.66 69.87 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 86.1 t -56.37 -40.51 67.26 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -64.26 -52.71 57.34 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 173.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -69.33 -26.13 64.55 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.572 1.078 . . . . 0.0 111.569 -171.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -71.13 -7.82 49.24 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.818 1.647 . . . . 0.0 112.461 171.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 51.6 mt -65.07 153.83 88.16 Favored Pre-proline 0 CA--C 1.537 0.47 0 O-C-N 120.746 -1.221 . . . . 0.0 109.62 169.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -53.63 142.45 60.73 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.405 2.737 . . . . 0.0 109.851 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -48.75 -41.51 32.41 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 123.683 0.793 . . . . 0.0 112.786 -172.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -73.65 -31.69 63.62 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 72.8 t -66.2 -48.17 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 170.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -55.03 -43.56 73.83 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 123.854 0.862 . . . . 0.0 110.919 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.41 -45.41 91.11 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 117.537 -1.22 . . . . 0.0 110.459 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -71.02 -39.92 72.06 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.742 1.156 . . . . 0.0 111.342 -177.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 699' ' ' LEU . . . . . 0.505 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 0.8 OUTLIER -64.36 -44.97 89.76 Favored 'General case' 0 C--O 1.226 -0.163 0 O-C-N 121.47 -0.769 . . . . 0.0 110.974 175.332 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 61.3 mt -58.15 -39.86 79.88 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 119.147 0.885 . . . . 0.0 109.821 173.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -64.92 -44.67 88.77 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 117.412 -1.28 . . . . 0.0 111.089 178.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.98 -50.48 64.04 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.639 1.563 . . . . 0.0 108.825 172.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 703' ' ' TRP . . . . . 0.505 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 49.6 m0 -68.23 -9.04 44.29 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.026 1.33 . . . . 0.0 113.532 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -110.31 -3.36 16.25 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.734 0.814 . . . . 0.0 112.182 169.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -91.32 -6.61 52.81 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.208 0.913 . . . . 0.0 109.509 168.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 54.4 p -131.08 4.63 4.44 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 114.131 1.159 . . . . 0.0 114.131 -169.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 N-CA-C 106.312 -2.715 . . . . 0.0 106.312 -176.052 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.645 0 CA-C-O 119.687 -0.507 . . . . 0.0 113.236 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 55.6 m80 -125.45 -21.92 4.42 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.354 1.462 . . . . 0.0 110.201 169.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 28.4 ttt -135.64 3.16 2.99 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.787 1.635 . . . . 0.0 110.903 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -140.9 175.66 2.95 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 127.184 2.193 . . . . 0.0 106.632 174.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -39.84 156.2 0.04 OUTLIER 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 123.476 2.784 . . . . 0.0 114.906 169.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.7 m -40.6 -39.33 1.03 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.651 1.98 . . . . 0.0 116.32 -169.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 16.4 p-10 -82.27 -69.05 0.65 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.972 1.309 . . . . 0.0 110.517 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.5 pt -62.38 160.46 2.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 125.807 1.643 . . . . 0.0 112.577 -172.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.57 166.48 20.66 Favored Pre-proline 0 N--CA 1.464 0.257 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 169.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -54.81 -37.99 92.24 Favored 'Trans proline' 0 CA--C 1.505 -0.973 0 C-N-CA 122.553 2.169 . . . . 0.0 113.725 -168.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -61.6 -54.84 37.58 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 13.9 t -65.89 -34.18 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 124.471 1.108 . . . . 0.0 109.811 -173.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 66.6 t80 -72.31 -37.4 68.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 122.906 0.482 . . . . 0.0 111.848 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -83.07 -16.86 45.28 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.547 0.612 . . . . 0.0 111.301 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -71.56 -12.55 61.42 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.544 1.138 . . . . 0.0 110.872 169.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 69.7 mt -73.61 152.44 89.5 Favored Pre-proline 0 CA--C 1.539 0.538 0 O-C-N 121.313 -0.867 . . . . 0.0 109.766 174.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -56.47 155.64 24.92 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 123.194 2.596 . . . . 0.0 111.528 172.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -42.07 46.9 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.527 0.731 . . . . 0.0 110.81 176.132 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -62.11 -53.46 55.16 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 -176.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 41.3 t -60.15 -32.47 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.476 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.9 mt-30 -68.84 -55.9 9.69 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 120.071 1.305 . . . . 0.0 108.606 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 697' ' ' LYS . . . . . 0.414 ' HE3' ' HB3' ' A' ' 697' ' ' LYS 0.335 0.0 OUTLIER -74.24 -30.79 62.32 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.248 -169.404 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -68.23 -39.97 82.15 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 119.671 1.123 . . . . 0.0 109.101 170.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -36.94 85.72 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.561 1.073 . . . . 0.0 110.116 174.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 15.1 mt -62.47 -42.26 99.36 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 119.114 0.87 . . . . 0.0 110.143 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.0 -42.17 81.15 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.869 0.759 . . . . 0.0 110.827 178.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -59.26 -53.19 61.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.142 1.377 . . . . 0.0 109.454 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -66.88 -32.15 73.22 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 118.408 -0.806 . . . . 0.0 110.923 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 704' ' ' LYS . . . . . 0.42 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -60.72 -25.94 66.81 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 119.566 1.075 . . . . 0.0 111.829 174.254 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -64.44 -12.39 43.01 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.963 1.256 . . . . 0.0 113.543 170.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 1.9 p -130.17 -17.36 3.45 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -169.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 N-CA-C 105.903 -2.879 . . . . 0.0 105.903 176.375 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -3' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 683' ' ' ILE . . . . . . . . 0 N--CA 1.47 0.942 0 N-CA-C 114.828 0.691 . . . . 0.0 114.828 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -35.99 75.9 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 118.31 1.055 . . . . 0.0 111.742 169.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 8.5 ptm -148.56 35.08 0.78 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.311 1.044 . . . . 0.0 110.171 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 679' ' ' PHE . . . . . 0.414 ' CZ ' ' CD2' ' A' ' 688' ' ' PHE . 5.7 m-85 -150.3 171.76 6.03 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 127.069 2.148 . . . . 0.0 106.402 -173.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -40.34 145.59 0.33 Allowed 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.615 2.21 . . . . 0.0 112.288 168.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 2.2 m -45.96 -39.34 8.8 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 114.781 1.401 . . . . 0.0 114.781 -168.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 682' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 11.7 p-10 -66.15 -85.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.885 2.074 . . . . 0.0 111.021 173.242 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 683' ' ' ILE . . . . . 0.419 ' O ' ' HA2' ' A' ' -3' ' ' GLY . 4.0 pt -55.16 118.21 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 C-N-CA 125.533 1.533 . . . . 0.0 110.107 -169.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.6 152.78 67.34 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 170.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -57.38 -37.17 98.32 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.163 2.575 . . . . 0.0 111.771 -169.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 686' ' ' GLN . . . . . 0.428 ' CD ' ' H ' ' A' ' 686' ' ' GLN . 2.5 mp0 -56.41 -55.37 34.37 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 5.2 t -60.82 -37.28 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 C-N-CA 124.532 1.133 . . . . 0.0 109.607 -176.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 72.0 t80 -69.61 -40.76 76.43 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 119.068 -0.491 . . . . 0.0 112.029 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -77.0 -20.29 56.23 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.456 1.026 . . . . 0.0 111.281 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -70.52 -11.22 60.79 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.282 1.033 . . . . 0.0 111.524 169.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 83.1 mt -70.59 152.32 95.34 Favored Pre-proline 0 CA--C 1.535 0.379 0 O-C-N 121.057 -1.027 . . . . 0.0 109.139 169.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -53.98 147.34 43.25 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.464 2.109 . . . . 0.0 110.162 175.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -40.95 -57.51 1.97 Allowed 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.069 1.348 . . . . 0.0 111.05 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.01 -25.04 63.4 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -173.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 78.9 t -67.31 -45.14 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 62.9 mt-30 -55.53 -43.24 75.59 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.249 0.547 . . . . 0.0 109.645 178.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -74.21 -40.75 62.25 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.218 -173.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -62.99 -40.08 96.7 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 119.219 0.918 . . . . 0.0 110.862 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.3 -38.61 91.65 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 119.468 1.031 . . . . 0.0 111.272 177.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.19 -44.38 84.15 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.923 0.783 . . . . 0.0 110.116 174.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.13 82.9 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 119.148 -0.453 . . . . 0.0 110.58 174.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.75 -54.83 33.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.463 1.105 . . . . 0.0 108.113 178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 22.1 m0 -65.73 -2.84 4.0 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.285 1.034 . . . . 0.0 113.045 176.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -117.13 5.06 12.71 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.861 1.209 . . . . 0.0 113.759 169.067 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 19.1 ptt180 -117.93 9.46 12.84 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.638 1.175 . . . . 0.0 111.461 169.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 28.8 p -125.9 -3.56 7.06 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.206 1.402 . . . . 0.0 111.884 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.577 0 N-CA-C 105.388 -3.085 . . . . 0.0 105.388 -172.645 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.493 0 N-CA-C 107.264 -2.334 . . . . 0.0 107.264 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -67.93 -21.88 65.09 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.019 0.91 . . . . 0.0 110.817 169.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 24.3 ttt -152.69 159.24 43.17 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 127.108 2.163 . . . . 0.0 105.359 173.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 64.39 164.43 0.12 Allowed Pre-proline 0 CA--C 1.552 1.047 0 CA-C-N 120.271 1.396 . . . . 0.0 110.385 -168.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -43.59 156.61 0.15 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.731 2.954 . . . . 0.0 114.826 169.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 4.2 m -60.67 -30.3 69.83 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.418 1.087 . . . . 0.0 113.539 -172.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -69.06 -9.94 55.07 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.848 2.459 . . . . 0.0 114.111 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 13.1 pt -145.82 -178.24 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 125.549 1.54 . . . . 0.0 108.323 -174.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -152.03 162.75 25.73 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 168.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -57.51 -36.71 98.65 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.213 1.942 . . . . 0.0 113.577 -168.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -62.37 -53.46 54.71 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -177.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 4.1 t -68.73 -33.19 58.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.748 -173.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.47 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 66.6 t80 -65.73 -39.39 91.09 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 118.391 0.541 . . . . 0.0 111.161 177.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -81.4 -16.6 51.67 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.68 -0.638 . . . . 0.0 111.551 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -75.18 -13.22 60.44 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.168 0.894 . . . . 0.0 110.832 169.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 64.6 mt -68.84 152.32 96.82 Favored Pre-proline 0 C--N 1.344 0.357 0 O-C-N 121.075 -1.016 . . . . 0.0 109.216 170.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -53.65 144.74 51.74 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.382 2.055 . . . . 0.0 110.745 173.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.05 -34.35 65.82 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.598 0.759 . . . . 0.0 112.791 -176.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.5 -38.78 74.38 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.701 -0.624 . . . . 0.0 112.49 173.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 96.2 t -61.53 -37.11 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 O-C-N 120.88 -1.137 . . . . 0.0 109.559 175.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.47 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 68.5 mt-30 -58.52 -53.93 52.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -51.75 -52.44 48.65 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.19 -36.14 79.11 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -171.077 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.03 -38.67 89.59 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.495 171.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.75 -38.35 87.66 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-N 119.425 1.012 . . . . 0.0 110.343 173.522 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.47 72.67 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.561 0.619 . . . . 0.0 110.901 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -60.44 -52.28 65.9 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 176.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.4 m0 -58.61 -46.1 87.75 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 118.531 -0.747 . . . . 0.0 110.06 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -68.13 -19.56 64.83 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 120.405 1.457 . . . . 0.0 112.643 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -84.87 -4.68 59.2 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 120.692 1.587 . . . . 0.0 113.083 169.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 37.5 p -126.3 -15.26 5.74 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.165 1.348 . . . . 0.0 112.325 -171.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.975 0 N-CA-C 106.282 -2.727 . . . . 0.0 106.282 169.869 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.226 0 N-CA-C 108.342 -1.903 . . . . 0.0 108.342 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 17.3 p80 -87.84 -15.4 36.92 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.44 1.096 . . . . 0.0 112.999 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 28.4 ttt -149.29 -33.77 0.2 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 120.195 1.361 . . . . 0.0 113.787 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -100.38 175.75 2.24 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-O 118.496 -0.764 . . . . 0.0 108.953 170.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo -42.77 161.31 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.719 2.946 . . . . 0.0 114.869 169.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 5.0 m -55.55 -27.37 48.59 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.173 1.545 . . . . 0.0 115.173 -169.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -91.03 -7.78 50.91 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.615 1.966 . . . . 0.0 113.512 -172.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.3 pt -140.05 170.27 15.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 125.72 1.608 . . . . 0.0 108.569 -174.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -151.82 170.04 8.53 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 168.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -54.58 -37.12 90.64 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.056 1.837 . . . . 0.0 113.062 -168.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -61.6 -55.73 27.58 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.47 -36.51 76.54 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 C-N-CA 124.833 1.253 . . . . 0.0 109.93 -172.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.416 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 52.6 t80 -73.49 -37.58 65.68 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.836 -0.54 . . . . 0.0 111.315 -178.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -81.36 -16.17 53.09 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.805 -0.559 . . . . 0.0 110.936 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -73.3 -13.43 61.12 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.343 1.057 . . . . 0.0 110.762 169.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 69.2 mt -73.72 152.86 89.34 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.142 -0.974 . . . . 0.0 109.108 172.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -54.69 142.54 72.75 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.076 1.851 . . . . 0.0 110.611 172.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.63 -33.91 64.45 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.583 0.753 . . . . 0.0 112.098 -179.091 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -72.45 -30.51 64.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.341 -0.849 . . . . 0.0 113.205 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 64.4 t -69.0 -42.44 82.11 Favored 'Isoleucine or valine' 0 C--O 1.23 0.051 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 172.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.416 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 73.8 mt-30 -54.82 -49.87 69.97 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -54.39 -46.98 73.19 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 175.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.62 -40.25 95.15 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.625 0.648 . . . . 0.0 110.499 -177.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 699' ' ' LEU . . . . . 0.408 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 0.2 OUTLIER -62.86 -32.65 73.93 Favored 'General case' 0 C--N 1.332 -0.152 0 C-N-CA 124.224 1.01 . . . . 0.0 111.375 175.689 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 18.8 mt -65.7 -41.54 92.24 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 120.066 1.303 . . . . 0.0 110.261 170.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.78 -38.35 90.76 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.45 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -59.58 -55.3 36.25 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 119.103 0.865 . . . . 0.0 109.43 173.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 703' ' ' TRP . . . . . 0.408 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 20.1 m0 -71.62 4.87 2.77 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.214 -0.929 . . . . 0.0 112.638 177.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 704' ' ' LYS . . . . . 0.473 ' HZ2' ' C ' ' A' ' 707' ' ' GLY 0.266 1.2 tppm? -124.4 10.79 8.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.588 1.155 . . . . 0.0 112.617 169.064 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -122.51 4.99 9.59 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.815 1.246 . . . . 0.0 110.98 168.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 32.5 p -121.6 -6.91 9.17 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.453 1.501 . . . . 0.0 111.656 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 707' ' ' GLY . . . . . 0.473 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.245 0.831 0 N-CA-C 105.531 -3.028 . . . . 0.0 105.531 -176.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.331 0 N-CA-C 107.915 -2.074 . . . . 0.0 107.915 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -2' ' ' HIS . . . . . 0.606 ' CG ' ' H ' ' A' ' -1' ' ' MET . 25.4 t-80 62.97 -172.32 0.16 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.914 1.286 . . . . 0.0 110.685 -171.122 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' -1' ' ' MET . . . . . 0.606 ' H ' ' CG ' ' A' ' -2' ' ' HIS . 13.3 tpt -105.03 -23.48 12.94 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.353 1.061 . . . . 0.0 111.706 -172.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -152.78 154.1 30.94 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 123.992 0.917 . . . . 0.0 109.985 172.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -68.53 -157.8 0.04 OUTLIER 'Trans proline' 0 CA--C 1.546 1.101 1 C-N-CA 125.885 4.39 . . . . 0.0 111.636 168.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 70.3 p -135.38 49.24 2.19 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.589 1.156 . . . . 0.0 109.248 -176.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.4 -58.39 0.13 Allowed 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.396 1.078 . . . . 0.0 109.383 -169.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 12.8 pt -69.93 128.97 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 123.565 0.746 . . . . 0.0 109.025 169.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -73.83 139.62 77.13 Favored Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 168.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.83 -37.09 97.66 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.698 2.266 . . . . 0.0 112.017 -174.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -68.88 -41.19 78.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.069 -0.491 . . . . 0.0 109.68 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 99.7 t -62.41 -40.74 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.466 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 84.5 t80 -62.45 -40.17 95.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 121.344 -0.847 . . . . 0.0 112.376 173.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -76.91 -10.86 59.65 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.488 -0.758 . . . . 0.0 111.998 -178.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -72.98 -21.27 60.87 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.502 1.047 . . . . 0.0 110.3 168.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 83.7 mt -61.25 151.16 77.24 Favored Pre-proline 0 CA--C 1.536 0.409 0 O-C-N 121.092 -1.005 . . . . 0.0 109.658 175.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -54.06 148.05 41.09 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 123.12 2.547 . . . . 0.0 110.981 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -34.06 -62.89 0.3 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 126.367 1.867 . . . . 0.0 111.331 176.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.48 -27.45 64.22 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -172.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 72.7 t -64.97 -45.62 94.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 174.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.466 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 60.1 mt-30 -56.84 -49.59 74.98 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -67.21 -33.04 74.52 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 116.93 -1.51 . . . . 0.0 111.893 -169.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -67.1 -50.5 61.38 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.244 1.384 . . . . 0.0 109.706 172.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -59.0 -38.74 79.9 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.396 0.998 . . . . 0.0 111.652 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 45.5 mt -67.99 -43.49 78.79 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.719 0.808 . . . . 0.0 109.994 176.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.25 -28.47 66.34 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.635 -0.698 . . . . 0.0 111.515 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -66.87 -61.35 2.0 Allowed 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 170.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.3 m0 -57.89 -20.55 37.66 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 117.339 -1.315 . . . . 0.0 112.071 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 4.2 mmpm? -89.28 -34.22 16.67 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 122.252 2.296 . . . . 0.0 112.794 169.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 7.5 ptp85 -65.64 -19.86 66.08 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 120.871 1.669 . . . . 0.0 110.744 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 24.3 p -106.38 21.33 17.58 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.788 1.235 . . . . 0.0 111.982 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 CA-C-O 118.358 -1.246 . . . . 0.0 110.258 175.023 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.564 0 CA-C-O 118.46 -1.189 . . . . 0.0 110.679 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -139.32 -15.91 1.08 Allowed 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.201 1.501 . . . . 0.0 114.521 -169.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 74.8 mtp -125.34 9.84 7.93 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.622 1.555 . . . . 0.0 112.431 -169.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -149.74 164.22 21.69 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 128.636 2.774 . . . . 0.0 104.409 169.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.271 0.0 OUTLIER -13.07 -75.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.805 1 C-N-CA 126.567 4.845 . . . . 0.0 119.669 -169.872 . . . . . . . . 4 3 . 1 . 010 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 59.1 m -160.91 -41.67 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 120.071 1.305 . . . . 0.0 110.463 172.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 19.2 p-10 -81.15 -61.54 1.92 Allowed 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.946 1.698 . . . . 0.0 109.217 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 3.4 pt -62.33 156.66 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 125.249 1.419 . . . . 0.0 111.605 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -137.94 165.85 30.56 Favored Pre-proline 0 C--N 1.329 -0.298 0 C-N-CA 126.803 2.041 . . . . 0.0 105.898 172.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -58.33 -36.32 97.76 Favored 'Trans proline' 0 CA--C 1.508 -0.775 0 C-N-CA 123.089 2.526 . . . . 0.0 113.795 -168.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -62.36 -54.7 36.55 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 17.8 t -60.08 -39.47 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.073 0 C-N-CA 124.981 1.312 . . . . 0.0 109.25 -174.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 68.7 t80 -70.52 -39.32 74.14 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.808 -177.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -82.84 -16.23 48.49 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.032 0.833 . . . . 0.0 111.234 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -71.24 -11.66 61.04 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.529 1.131 . . . . 0.0 110.656 168.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 53.6 mt -76.5 152.4 83.41 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 124.027 0.931 . . . . 0.0 109.284 171.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -56.2 146.99 68.44 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.944 2.429 . . . . 0.0 110.947 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -46.76 -49.91 18.99 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.075 0.95 . . . . 0.0 112.003 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.55 -28.28 67.66 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -177.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 81.8 t -69.48 -36.93 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 CA-C-N 118.747 0.703 . . . . 0.0 109.493 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 70.7 mt-30 -65.38 -46.45 80.05 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.231 1.015 . . . . 0.0 108.365 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -50.26 74.54 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.607 178.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.82 -39.52 90.94 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 123.32 0.648 . . . . 0.0 111.515 -175.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -40.81 95.67 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 121.283 -0.885 . . . . 0.0 109.81 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 40.3 mt -65.36 -41.14 94.12 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.085 0.857 . . . . 0.0 110.409 174.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.74 -40.7 93.4 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.963 -0.542 . . . . 0.0 110.446 175.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.28 -54.86 38.64 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.014 0.925 . . . . 0.0 108.824 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -67.46 0.8 2.7 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.347 1.059 . . . . 0.0 113.066 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -122.14 7.16 9.71 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.425 1.011 . . . . 0.0 113.19 169.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -118.4 13.28 13.54 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.563 1.145 . . . . 0.0 111.52 170.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 23.3 p -129.92 -7.12 4.46 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.235 1.414 . . . . 0.0 111.958 -176.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.947 0 N-CA-C 104.332 -3.507 . . . . 0.0 104.332 -169.866 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.012 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 14.1 m170 73.52 -53.26 0.7 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 127.263 2.225 . . . . 0.0 113.623 171.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 18.1 ptm -151.21 17.47 0.75 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.121 0.969 . . . . 0.0 110.767 169.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 679' ' ' PHE . . . . . 0.414 ' CZ ' ' CD2' ' A' ' 688' ' ' PHE . 11.8 m-85 -136.4 171.4 8.79 Favored Pre-proline 0 C--O 1.243 0.752 0 C-N-CA 127.182 2.193 . . . . 0.0 106.419 177.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -38.1 150.29 0.06 OUTLIER 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.933 3.089 . . . . 0.0 113.668 169.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.3 m -44.13 -41.55 5.73 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.711 1.604 . . . . 0.0 114.847 -169.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -69.74 -81.37 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.289 2.236 . . . . 0.0 112.084 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.7 pt -53.08 114.14 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 C-N-CA 127.212 2.205 . . . . 0.0 112.842 -169.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.9 145.44 98.92 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 168.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -59.48 -31.63 94.99 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.075 1.85 . . . . 0.0 112.142 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -66.51 -45.87 78.1 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 45.0 t -59.96 -42.36 89.2 Favored 'Isoleucine or valine' 0 C--N 1.342 0.281 0 C-N-CA 123.642 0.777 . . . . 0.0 109.435 174.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.414 ' CD2' ' CZ ' ' A' ' 679' ' ' PHE . 72.8 t80 -62.25 -39.64 93.52 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.544 -176.039 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -82.28 -16.09 50.68 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.19 0.904 . . . . 0.0 112.334 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -71.28 -23.3 61.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.497 0.719 . . . . 0.0 110.346 169.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 85.5 mt -58.69 147.17 72.05 Favored Pre-proline 0 CA--C 1.538 0.482 0 O-C-N 121.115 -0.991 . . . . 0.0 109.604 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -54.92 147.78 50.21 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.457 2.105 . . . . 0.0 110.476 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -49.46 -48.31 47.68 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.481 0.712 . . . . 0.0 111.466 -175.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.37 -26.24 64.57 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.707 1.002 . . . . 0.0 113.707 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 69.7 t -71.4 -37.97 66.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 118.889 0.768 . . . . 0.0 109.277 172.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.36 -47.45 79.27 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 122.565 1.174 . . . . 0.0 107.849 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.03 -46.35 91.06 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.276 -1.329 . . . . 0.0 109.893 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.79 -39.88 91.39 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 118.733 0.697 . . . . 0.0 111.138 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -40.23 96.58 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.198 0.908 . . . . 0.0 110.396 175.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 47.5 mt -66.9 -39.81 87.52 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.463 -0.773 . . . . 0.0 110.528 175.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.87 -38.45 91.15 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.606 0.639 . . . . 0.0 110.512 174.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -62.19 -54.57 39.09 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.694 1.197 . . . . 0.0 108.428 177.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.5 m0 -66.5 -6.6 15.43 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.246 -0.909 . . . . 0.0 113.225 176.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 704' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -108.96 1.56 20.75 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 117.979 -1.01 . . . . 0.0 113.06 169.735 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -117.92 -3.08 11.2 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.751 1.221 . . . . 0.0 112.661 169.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.7 p -116.16 -8.12 11.79 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.578 1.551 . . . . 0.0 110.973 174.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.458 0 C-N-CA 130.099 3.714 . . . . 0.0 104.091 169.624 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.471 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -154.53 178.63 9.86 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.561 -0.904 . . . . 0.0 108.561 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 7.0 tpt -113.06 -168.83 1.38 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.489 1.915 . . . . 0.0 106.948 170.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 679' ' ' PHE . . . . . 0.401 ' CD1' HD11 ' A' ' 683' ' ' ILE . 22.0 m-30 -44.59 113.28 1.66 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.216 1.006 . . . . 0.0 110.609 169.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -55.34 -34.35 88.42 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.905 3.07 . . . . 0.0 115.853 -173.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 29.0 m 115.11 -6.35 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 130.971 3.709 . . . . 0.0 109.916 -170.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -68.7 -13.72 62.55 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.507 1.923 . . . . 0.0 111.019 168.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 683' ' ' ILE . . . . . 0.425 HD12 ' CD1' ' A' ' 688' ' ' PHE . 10.1 pt -135.2 146.57 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.992 0 C-N-CA 127.258 2.223 . . . . 0.0 109.342 -176.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -91.23 143.89 29.02 Favored Pre-proline 0 CA--C 1.541 0.615 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 167.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -57.62 -40.38 80.51 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.718 2.279 . . . . 0.0 112.561 -174.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -68.35 -43.85 76.53 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.38 -40.52 88.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 84.2 t80 -58.66 -38.64 78.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 121.681 -0.637 . . . . 0.0 112.096 176.574 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -80.68 -15.91 55.34 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.858 0.754 . . . . 0.0 112.727 -179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -73.36 -19.97 60.88 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.333 0.97 . . . . 0.0 110.813 169.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.77 148.82 66.82 Favored Pre-proline 0 CA--C 1.536 0.411 0 O-C-N 120.905 -1.122 . . . . 0.0 109.463 172.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -54.34 147.29 46.99 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 122.483 2.122 . . . . 0.0 110.576 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 693' ' ' GLU . . . . . 0.431 ' CD ' ' HZ3' ' A' ' 697' ' ' LYS . 45.1 tp10 -38.11 -58.56 0.95 Allowed 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 125.461 1.504 . . . . 0.0 110.945 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.83 -25.09 62.68 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -173.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.41 -43.47 87.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 119.351 0.978 . . . . 0.0 108.595 173.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.458 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 66.7 mt-30 -57.49 -45.5 84.83 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 697' ' ' LYS . . . . . 0.431 ' HZ3' ' CD ' ' A' ' 693' ' ' GLU . 11.5 mptt -71.78 -33.89 68.98 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.529 -174.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -66.63 -46.45 75.79 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.324 1.05 . . . . 0.0 111.213 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.63 -43.08 99.52 Favored 'General case' 0 N--CA 1.461 0.097 0 O-C-N 121.412 -0.805 . . . . 0.0 110.168 177.198 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.01 -41.07 91.33 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.928 -0.482 . . . . 0.0 111.008 172.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -59.48 -48.14 82.79 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 117.666 -1.159 . . . . 0.0 109.806 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -62.05 -45.63 92.72 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 120.348 1.431 . . . . 0.0 111.449 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 31.1 m0 -63.62 -14.13 48.74 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 120.501 -1.374 . . . . 0.0 112.506 175.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 704' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.6 OUTLIER -101.74 -17.85 16.08 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.726 1.211 . . . . 0.0 112.928 169.56 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -67.77 -41.29 83.5 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 121.412 1.915 . . . . 0.0 109.033 171.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 17.7 p -73.38 24.33 0.07 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.913 2.085 . . . . 0.0 113.539 -172.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 -172.26 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -3' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 683' ' ' ILE . . . . . . . . 0 N--CA 1.464 0.562 0 N-CA-C 112.268 -0.333 . . . . 0.0 112.268 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -132.24 -19.84 2.46 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.766 1.226 . . . . 0.0 109.939 169.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 25.5 ptm -137.15 19.99 2.98 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.464 0.706 . . . . 0.0 111.624 169.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -147.33 156.13 46.15 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 128.682 2.793 . . . . 0.0 104.803 169.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.279 0.0 OUTLIER -12.15 -88.18 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.791 1 C-N-CA 126.723 4.949 . . . . 0.0 118.664 -171.661 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 69.0 m -158.76 -39.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.785 1.175 . . . . 0.0 110.507 177.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 682' ' ' ASP . . . . . 0.447 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 19.0 p-10 -75.75 -74.22 0.23 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.541 1.536 . . . . 0.0 108.688 171.223 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 683' ' ' ILE . . . . . 0.447 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 6.2 pt -58.44 156.53 2.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 C-N-CA 126.422 1.889 . . . . 0.0 111.681 -176.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -141.68 169.9 10.28 Favored Pre-proline 0 C--N 1.331 -0.201 0 C-N-CA 125.786 1.634 . . . . 0.0 106.806 169.59 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -55.29 -36.2 93.06 Favored 'Trans proline' 0 CA--C 1.506 -0.905 0 C-N-CA 122.567 2.178 . . . . 0.0 113.81 -168.64 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -63.14 -56.08 19.81 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 11.9 t -61.78 -37.39 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 C-N-CA 124.305 1.042 . . . . 0.0 109.546 -173.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 75.8 t80 -75.32 -40.83 58.02 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 123.345 0.658 . . . . 0.0 111.341 -176.257 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -82.05 -14.1 56.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.059 0.845 . . . . 0.0 110.934 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -74.36 -9.67 58.83 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.834 1.254 . . . . 0.0 110.325 168.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 54.3 mt -76.34 152.92 83.96 Favored Pre-proline 0 CA--C 1.534 0.339 0 O-C-N 121.499 -0.751 . . . . 0.0 109.144 170.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -55.6 146.7 63.23 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.755 2.303 . . . . 0.0 110.653 177.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -46.39 -49.81 17.44 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 124.249 1.02 . . . . 0.0 111.943 -176.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.46 -28.12 66.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.316 -0.85 . . . . 0.0 113.237 -177.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 90.6 t -68.93 -38.05 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 118.922 0.783 . . . . 0.0 109.406 172.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.43 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 72.8 mt-30 -63.99 -47.7 79.33 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 -178.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.58 -46.54 89.85 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.08 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -62.66 -43.11 99.64 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.11 0.964 . . . . 0.0 111.63 -178.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.0 -39.27 90.16 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.385 0.674 . . . . 0.0 110.247 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 36.0 mt -63.4 -41.37 98.75 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 118.909 0.777 . . . . 0.0 110.243 172.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.75 97.78 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.958 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -61.35 -47.09 87.49 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 119.371 0.987 . . . . 0.0 110.825 177.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 25.0 m0 -68.93 0.05 4.96 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.315 -0.866 . . . . 0.0 112.618 173.197 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 704' ' ' LYS . . . . . 0.513 ' HZ2' ' C ' ' A' ' 707' ' ' GLY . 1.2 tppm? -117.56 3.66 12.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.358 1.463 . . . . 0.0 112.175 168.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -95.17 -11.4 28.17 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.911 1.285 . . . . 0.0 109.53 168.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 17.1 p -122.58 -3.68 8.79 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.565 1.146 . . . . 0.0 113.69 -168.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 707' ' ' GLY . . . . . 0.513 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.251 1.162 0 N-CA-C 106.158 -2.777 . . . . 0.0 106.158 -175.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.595 0 CA-C-O 118.983 -0.899 . . . . 0.0 111.679 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -2' ' ' HIS . . . . . 0.4 ' CG ' ' H ' ' A' ' -1' ' ' MET 0.289 0.0 OUTLIER 40.82 -130.47 0.4 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 127.958 2.503 . . . . 0.0 114.421 172.72 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' -1' ' ' MET . . . . . 0.4 ' H ' ' CG ' ' A' ' -2' ' ' HIS . 0.0 OUTLIER -101.26 -159.74 0.75 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.655 1.982 . . . . 0.0 108.671 -179.447 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -47.29 130.46 9.86 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 125.115 1.366 . . . . 0.0 111.64 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -54.5 -14.09 6.56 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.797 2.998 . . . . 0.0 113.642 169.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . 0.258 26.6 m 76.06 8.0 3.54 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 127.152 2.181 . . . . 0.0 113.291 174.078 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -74.76 -40.05 61.43 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 167.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 14.1 pt -76.0 127.22 37.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 127.204 2.202 . . . . 0.0 107.92 168.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -72.49 141.6 83.08 Favored Pre-proline 0 CA--C 1.543 0.677 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 167.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.84 -37.47 96.2 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.499 2.133 . . . . 0.0 112.057 -173.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -69.26 -42.75 75.15 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 64.9 t -59.75 -40.15 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 C-N-CA 123.359 0.664 . . . . 0.0 109.455 176.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.442 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 74.4 t80 -62.7 -42.41 99.63 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.378 -0.826 . . . . 0.0 112.016 176.252 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -75.96 -12.03 60.07 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.941 0.791 . . . . 0.0 112.182 -178.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -73.43 -20.75 60.64 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.446 1.021 . . . . 0.0 110.12 168.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 87.3 mt -60.07 151.04 67.84 Favored Pre-proline 0 CA--C 1.536 0.439 0 O-C-N 120.885 -1.134 . . . . 0.0 109.205 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -54.93 148.06 48.93 Favored 'Trans proline' 0 N--CA 1.452 -0.935 0 C-N-CA 122.607 2.205 . . . . 0.0 110.446 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 693' ' ' GLU . . . . . 0.459 ' CD ' ' HZ3' ' A' ' 697' ' ' LYS . 45.8 tp10 -41.32 -57.47 2.13 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.055 1.342 . . . . 0.0 111.262 -179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.8 -27.96 66.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -174.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 98.9 t -67.76 -45.1 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 176.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.442 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 70.0 mt-30 -55.36 -44.5 76.06 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 122.024 0.916 . . . . 0.0 109.318 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 697' ' ' LYS . . . . . 0.459 ' HZ3' ' CD ' ' A' ' 693' ' ' GLU . 9.1 mptt -69.87 -41.37 74.9 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 117.622 -1.18 . . . . 0.0 110.347 -171.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -69.9 -43.77 71.07 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 119.614 1.097 . . . . 0.0 111.022 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -56.39 -46.56 80.06 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.877 0.762 . . . . 0.0 110.941 174.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 32.2 mt -69.03 -33.97 74.47 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.472 -0.767 . . . . 0.0 111.461 178.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.99 -34.74 73.74 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 119.257 0.935 . . . . 0.0 110.903 176.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -67.73 -51.81 44.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.349 1.06 . . . . 0.0 109.007 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -59.94 -34.09 72.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 120.965 -1.084 . . . . 0.0 110.9 176.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 704' ' ' LYS . . . . . 0.465 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.3 OUTLIER -74.99 -35.63 62.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 117.666 -1.159 . . . . 0.0 112.777 175.173 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -74.71 -14.02 60.68 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 120.877 1.671 . . . . 0.0 111.899 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 36.0 p -103.7 18.94 20.82 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.279 1.032 . . . . 0.0 111.938 -178.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.856 0 CA-C-O 117.188 -1.895 . . . . 0.0 108.724 179.098 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -3' ' ' GLY . . . . . 0.452 ' HA3' ' CG ' ' A' ' 684' ' ' ASP . . . . . . . . 0 N--CA 1.46 0.282 0 N-CA-C 110.622 -0.991 . . . . 0.0 110.622 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 38.2 p-80 -138.37 -9.83 1.46 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.171 1.388 . . . . 0.0 112.569 -175.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 24.8 ttt -127.54 7.33 6.32 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.811 1.244 . . . . 0.0 110.556 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -147.44 177.18 1.86 Allowed Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 127.64 2.376 . . . . 0.0 106.282 177.086 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -40.19 163.28 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.873 3.048 . . . . 0.0 116.127 169.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.8 m -49.68 -29.87 8.14 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.732 1.613 . . . . 0.0 115.121 -169.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -90.15 -68.5 0.78 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.664 1.586 . . . . 0.0 110.789 177.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.5 pt -66.61 162.1 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 125.877 1.671 . . . . 0.0 113.083 -171.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 684' ' ' ASP . . . . . 0.452 ' CG ' ' HA3' ' A' ' -3' ' ' GLY . 0.7 OUTLIER -140.84 166.29 23.81 Favored Pre-proline 0 N--CA 1.468 0.467 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 169.684 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -56.9 -34.67 97.57 Favored 'Trans proline' 0 CA--C 1.505 -0.958 0 C-N-CA 122.533 2.156 . . . . 0.0 113.666 -168.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -63.38 -55.71 22.19 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -178.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 17.6 t -65.93 -34.46 70.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 124.218 1.007 . . . . 0.0 109.431 -173.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.431 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 79.5 t80 -70.74 -41.74 71.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 121.893 -0.504 . . . . 0.0 111.495 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -82.63 -13.75 55.93 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.232 0.924 . . . . 0.0 111.015 -179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -71.59 -17.17 62.3 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.36 1.064 . . . . 0.0 109.954 168.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 70.4 mt -66.55 152.51 94.83 Favored Pre-proline 0 C--N 1.344 0.364 0 O-C-N 121.199 -0.938 . . . . 0.0 109.765 174.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -55.06 147.12 54.92 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.023 2.482 . . . . 0.0 110.252 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -46.62 -50.74 17.11 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 124.181 0.993 . . . . 0.0 112.436 -172.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.0 93.35 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 57.8 t -61.23 -38.09 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 O-C-N 121.357 -0.839 . . . . 0.0 109.531 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.431 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 60.8 mt-30 -64.0 -48.12 77.65 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.222 0.465 . . . . 0.0 110.468 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.6 -48.53 80.52 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -176.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.51 -37.03 76.99 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 122.736 0.414 . . . . 0.0 110.344 -173.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.55 -42.53 91.75 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.829 0.741 . . . . 0.0 110.192 175.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.03 -40.68 94.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.796 0.725 . . . . 0.0 110.711 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.59 -38.23 70.89 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.57 0.623 . . . . 0.0 111.912 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 39.8 tp10 -69.42 -41.65 76.07 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.43 1.092 . . . . 0.0 110.099 -179.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -61.31 -45.33 94.91 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.185 -0.947 . . . . 0.0 109.087 170.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.5 tptp -60.83 -24.51 65.93 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.504 1.047 . . . . 0.0 112.96 176.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -73.01 -11.73 60.67 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.307 1.043 . . . . 0.0 112.166 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.57 -13.46 1.99 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -168.548 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.848 0 N-CA-C 105.072 -3.211 . . . . 0.0 105.072 170.188 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -3' ' ' GLY . . . . . 0.45 ' H1 ' ' C ' ' A' ' 707' ' ' GLY . . . . . . . . 0 C--O 1.224 -0.516 0 N-CA-C 107.683 -2.167 . . . . 0.0 107.683 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -73.85 25.95 0.07 Allowed 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 118.63 1.215 . . . . 0.0 113.529 -175.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 11.3 tpt -155.92 153.51 29.75 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.941 2.096 . . . . 0.0 105.906 170.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.26 132.83 52.0 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-O 117.654 -1.165 . . . . 0.0 107.903 170.291 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.88 -25.09 26.29 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.453 2.102 . . . . 0.0 113.441 170.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 15.2 m 67.27 15.45 9.97 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.88 1.672 . . . . 0.0 113.692 173.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -76.76 -41.09 46.15 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.605 1.562 . . . . 0.0 107.577 168.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.1 pt -81.89 139.2 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 C-N-CA 128.021 2.528 . . . . 0.0 108.301 169.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -73.57 144.2 83.2 Favored Pre-proline 0 CA--C 1.542 0.66 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 168.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -60.66 -38.07 74.66 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 121.727 1.618 . . . . 0.0 111.526 -175.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -63.62 -47.39 81.61 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 58.4 t -61.71 -37.12 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -176.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 86.5 t80 -62.83 -47.49 83.2 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.389 -0.82 . . . . 0.0 112.235 171.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -74.22 -14.22 60.9 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.204 -0.935 . . . . 0.0 111.701 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -73.82 -14.54 61.11 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.676 1.19 . . . . 0.0 110.646 169.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 77.3 mt -64.77 152.74 89.64 Favored Pre-proline 0 CA--C 1.537 0.445 0 O-C-N 121.022 -1.049 . . . . 0.0 109.697 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -55.3 144.07 73.17 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.139 2.559 . . . . 0.0 109.945 177.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -44.94 -50.09 10.71 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.613 1.165 . . . . 0.0 112.079 -174.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.46 -32.3 73.05 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 97.4 t -67.11 -40.1 84.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 176.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.43 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 74.0 mt-30 -62.54 -48.67 78.51 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 -177.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -45.04 79.53 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.114 -175.13 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -67.5 -43.18 81.52 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.02 0.827 . . . . 0.0 111.598 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 699' ' ' LEU . . . . . 0.411 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 2.0 mm? -63.06 -35.98 82.07 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 120.988 -1.07 . . . . 0.0 112.249 174.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 39.9 mt -69.7 -38.2 76.88 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 177.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.48 -36.84 83.76 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.684 -0.674 . . . . 0.0 110.352 173.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -63.8 -54.08 40.8 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.528 1.131 . . . . 0.0 109.456 176.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 703' ' ' TRP . . . . . 0.411 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 31.3 m0 -62.36 -25.34 67.86 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 120.846 -1.159 . . . . 0.0 111.587 177.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 704' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.5 OUTLIER -81.39 -32.81 32.66 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 117.177 -1.392 . . . . 0.0 112.766 173.28 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -82.34 -27.51 32.16 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.977 1.717 . . . . 0.0 111.432 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 27.9 p -86.72 155.36 20.39 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 707' ' ' GLY . . . . . 0.45 ' C ' ' H1 ' ' A' ' -3' ' ' GLY . . . . . . . . 0 C--O 1.247 0.91 0 N-CA-C 107.422 -2.271 . . . . 0.0 107.422 168.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.149 0 CA-C-O 118.835 -0.98 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -132.76 -3.25 3.27 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 118.039 0.919 . . . . 0.0 112.32 -169.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -172.35 -47.91 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.95 2.1 . . . . 0.0 105.59 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 679' ' ' PHE . . . . . 0.428 ' CZ ' ' CD2' ' A' ' 688' ' ' PHE . 24.8 m-85 -76.74 170.64 15.23 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 124.501 1.12 . . . . 0.0 108.24 168.136 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -39.47 161.09 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 125.008 3.805 . . . . 0.0 116.446 171.144 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 5.8 m -45.62 -35.78 4.3 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 126.604 1.962 . . . . 0.0 115.849 -169.521 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -81.26 -61.98 1.79 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.621 1.1 . . . . 0.0 110.494 174.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.23 168.34 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 125.247 2.451 . . . . 0.0 114.512 -169.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -146.56 148.95 35.52 Favored Pre-proline 0 C--N 1.322 -0.613 0 C-N-CA 129.288 3.035 . . . . 0.0 104.551 -173.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -59.97 -33.63 95.51 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 CA-C-N 121.892 1.712 . . . . 0.0 112.516 -174.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -63.61 -50.45 69.32 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 109.074 -0.714 . . . . 0.0 109.074 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 29.9 t -64.51 -38.61 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 C-N-CA 123.674 0.79 . . . . 0.0 109.086 -178.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.428 ' CD2' ' CZ ' ' A' ' 679' ' ' PHE . 70.3 t80 -68.07 -40.93 82.6 Favored 'General case' 0 N--CA 1.444 -0.762 0 O-C-N 121.632 -0.667 . . . . 0.0 111.658 -177.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -81.57 -14.48 56.76 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.989 0.813 . . . . 0.0 111.811 -179.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -67.91 -24.67 65.23 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.671 0.789 . . . . 0.0 109.747 169.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 55.6 mt -63.28 148.53 93.09 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 121.604 -0.685 . . . . 0.0 109.546 173.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -55.62 147.87 57.18 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.726 2.284 . . . . 0.0 110.691 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -47.59 -49.71 26.01 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.879 0.872 . . . . 0.0 111.718 -175.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.54 -27.24 66.8 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -177.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 97.0 t -71.66 -36.74 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 118.826 0.739 . . . . 0.0 109.386 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -65.0 -44.83 87.93 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 122.248 1.023 . . . . 0.0 108.493 -178.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.13 -50.74 70.69 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.184 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -65.18 -38.34 90.2 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 122.955 0.502 . . . . 0.0 111.421 -176.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.85 -42.29 95.01 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 119.986 1.266 . . . . 0.0 110.083 177.382 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.95 -36.5 84.18 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.329 0.513 . . . . 0.0 110.832 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.26 -37.75 71.93 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.379 0.672 . . . . 0.0 111.123 176.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.91 -50.95 62.62 Favored 'General case' 0 CA--C 1.516 -0.343 0 C-N-CA 125.037 1.335 . . . . 0.0 108.65 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -57.51 -48.25 79.76 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 121.561 -0.712 . . . . 0.0 109.151 174.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.6 tpmp? -69.12 -11.0 60.4 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 117.329 -1.319 . . . . 0.0 113.928 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -105.09 6.06 32.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 121.45 1.932 . . . . 0.0 111.839 173.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 34.8 p -125.66 -17.17 5.55 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.028 0.931 . . . . 0.0 111.861 176.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 N-CA-C 106.856 -2.497 . . . . 0.0 106.856 169.991 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.852 0 CA-C-O 118.624 -1.098 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . 0.268 0.0 OUTLIER 52.92 2.11 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 131.321 3.848 . . . . 0.0 118.954 176.16 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 25.6 ptm -161.43 -1.19 0.05 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -170.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 679' ' ' PHE . . . . . 0.421 ' CD1' ' HD2' ' A' ' 680' ' ' PRO . 0.4 OUTLIER -100.92 157.75 33.09 Favored Pre-proline 0 CA--C 1.541 0.613 0 CA-C-N 120.2 1.364 . . . . 0.0 110.089 -169.669 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 680' ' ' PRO . . . . . 0.421 ' HD2' ' CD1' ' A' ' 679' ' ' PHE . 6.2 Cg_exo -54.57 138.79 75.54 Favored 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 121.927 1.752 . . . . 0.0 110.846 168.423 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 16.9 m 46.78 24.79 0.37 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.066 1.347 . . . . 0.0 112.92 -170.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . 0.374 12.2 t0 32.25 41.0 0.02 OUTLIER 'General case' 0 C--O 1.233 0.234 0 C-N-CA 129.537 3.135 . . . . 0.0 116.114 -169.076 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 4.5 pt -53.13 148.62 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 122.797 1.284 . . . . 0.0 109.343 169.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -70.84 135.9 85.44 Favored Pre-proline 0 N--CA 1.444 -0.729 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 170.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -55.19 -36.69 93.83 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.854 1.703 . . . . 0.0 111.452 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -64.94 -44.5 89.28 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -176.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 51.4 t -69.06 -42.58 82.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -56.56 -45.11 81.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.157 -0.964 . . . . 0.0 113.444 173.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -84.93 -5.75 59.34 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 118.763 0.71 . . . . 0.0 111.587 -174.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -77.04 -22.38 53.05 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.783 1.233 . . . . 0.0 109.252 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 91.3 mt -58.98 150.55 60.44 Favored Pre-proline 0 CA--C 1.534 0.346 0 O-C-N 121.389 -0.82 . . . . 0.0 109.968 175.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -53.49 147.63 37.42 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 123.253 2.635 . . . . 0.0 110.631 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -48.73 -48.59 40.45 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.602 0.761 . . . . 0.0 111.428 -174.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.85 -25.79 63.9 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -178.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 89.3 t -70.9 -43.77 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 119.288 0.949 . . . . 0.0 108.858 172.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -58.52 -47.26 84.73 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.66 0.664 . . . . 0.0 109.314 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.72 -43.26 97.06 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 117.973 -1.013 . . . . 0.0 109.904 -179.219 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -66.8 -39.14 87.64 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 119.255 0.934 . . . . 0.0 111.038 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -42.87 96.2 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 121.409 -0.807 . . . . 0.0 109.467 176.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 32.2 mt -63.79 -40.97 97.94 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.967 0.803 . . . . 0.0 110.911 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -62.52 -40.92 98.32 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.726 -0.655 . . . . 0.0 110.337 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -60.13 -54.46 45.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 26.9 m0 -66.99 0.23 2.69 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.524 1.13 . . . . 0.0 113.261 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 704' ' ' LYS . . . . . 0.504 ' HZ2' ' C ' ' A' ' 707' ' ' GLY . 1.2 tppm? -125.55 10.91 7.91 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.786 -1.196 . . . . 0.0 113.63 169.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -117.99 13.91 14.03 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.714 1.206 . . . . 0.0 110.542 169.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 24.7 p -131.92 -7.41 3.52 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.148 1.779 . . . . 0.0 111.518 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 707' ' ' GLY . . . . . 0.504 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.253 1.289 0 N-CA-C 104.665 -3.374 . . . . 0.0 104.665 -169.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.955 0 CA-C-O 117.271 -1.85 . . . . 0.0 116.008 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 57.2 t60 65.19 -44.43 0.35 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 118.493 2.775 . . . . 0.0 118.493 174.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.82 171.39 19.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 120.589 1.541 . . . . 0.0 109.665 -172.681 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.25 132.89 90.42 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 171.082 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -62.21 -160.61 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.528 3.485 . . . . 0.0 112.108 168.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 14.4 m -148.58 17.73 1.03 Allowed 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.413 -1.429 . . . . 0.0 111.736 176.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -87.71 -38.66 15.63 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.375 1.47 . . . . 0.0 109.219 169.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 12.9 pt -83.9 145.26 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 C-N-CA 124.845 1.258 . . . . 0.0 110.669 170.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -84.3 142.59 40.92 Favored Pre-proline 0 CA--C 1.541 0.632 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 168.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -74.77 -29.0 9.13 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 CA-C-N 120.286 1.138 . . . . 0.0 111.064 -171.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -69.14 -43.76 73.71 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 119.481 1.037 . . . . 0.0 109.09 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 92.2 t -56.58 -44.82 81.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 174.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.403 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 90.7 t80 -59.58 -43.14 93.72 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 175.403 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -78.13 -13.08 60.0 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.761 1.164 . . . . 0.0 112.367 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -82.09 -7.01 59.6 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.019 0.928 . . . . 0.0 110.933 168.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 71.8 mt -65.61 152.91 91.75 Favored Pre-proline 0 CA--C 1.534 0.354 0 O-C-N 121.036 -1.04 . . . . 0.0 109.083 169.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -55.2 145.99 62.5 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.074 2.516 . . . . 0.0 110.511 178.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 32.3 tp10 -46.21 -50.18 16.16 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.267 1.027 . . . . 0.0 112.09 -174.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.88 -29.47 67.77 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -177.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 94.2 t -68.04 -41.34 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.403 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.3 mt-30 -63.31 -46.68 85.55 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 -177.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -40.9 85.74 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 117.393 -1.289 . . . . 0.0 110.57 -175.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -69.8 -43.69 71.56 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 119.921 1.237 . . . . 0.0 111.146 179.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 699' ' ' LEU . . . . . 0.456 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 1.5 mm? -61.76 -42.87 99.55 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 121.132 -0.98 . . . . 0.0 111.041 177.345 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 27.5 mt -64.69 -39.52 93.81 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.394 0.543 . . . . 0.0 110.696 176.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -56.38 -55.97 26.94 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-O 115.968 -1.968 . . . . 0.0 108.537 170.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -49.32 -49.16 45.22 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 122.558 2.436 . . . . 0.0 110.122 175.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 703' ' ' TRP . . . . . 0.456 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 44.4 m0 -70.56 -4.51 23.4 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -175.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 1.7 tppm? -135.67 -5.97 2.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 121.148 1.795 . . . . 0.0 115.029 169.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -77.19 -37.51 53.42 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 127.184 2.194 . . . . 0.0 109.095 170.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.52 61.34 0.72 Allowed 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 -168.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.039 0 N-CA-C 109.364 -1.494 . . . . 0.0 109.364 -169.619 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.362 0 N-CA-C 108.795 -1.722 . . . . 0.0 108.795 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -146.7 169.05 19.83 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 170.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 12.5 tpt -56.22 -22.73 31.19 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.006 0.923 . . . . 0.0 113.038 -172.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -147.11 152.95 44.52 Favored Pre-proline 0 N--CA 1.449 -0.483 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 168.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -60.48 -36.78 84.97 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.816 2.344 . . . . 0.0 112.297 177.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 19.3 m 116.93 16.57 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 131.528 3.931 . . . . 0.0 110.39 -178.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -114.97 -37.94 4.03 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.761 1.624 . . . . 0.0 112.808 -169.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.3 pt -92.1 138.65 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.723 1.209 . . . . 0.0 111.617 -173.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -65.69 138.75 96.77 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 168.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.61 -28.12 10.2 Favored 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 121.278 1.319 . . . . 0.0 111.165 -169.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 23.6 mm100 -69.1 -46.77 66.91 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 119.484 1.038 . . . . 0.0 108.436 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 89.3 t -57.99 -36.03 54.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.339 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 688' ' ' PHE . . . . . 0.409 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 73.0 t80 -68.89 -53.04 23.4 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 119.363 0.983 . . . . 0.0 113.608 169.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -75.87 -10.64 59.6 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.968 -1.082 . . . . 0.0 112.954 -169.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -83.91 -1.87 55.37 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.808 1.243 . . . . 0.0 111.196 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 58.7 mt -70.59 156.65 91.63 Favored Pre-proline 0 CA--C 1.535 0.397 0 O-C-N 120.859 -1.151 . . . . 0.0 109.415 169.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -56.33 142.77 87.92 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.251 2.634 . . . . 0.0 110.696 177.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.02 -36.06 67.54 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.688 0.795 . . . . 0.0 112.948 -172.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.96 -33.27 70.29 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.297 -0.877 . . . . 0.0 113.093 175.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 75.5 t -65.11 -43.34 95.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 173.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.409 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.4 mt-30 -56.48 -53.12 61.21 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -53.45 -41.36 66.06 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 118.089 -0.958 . . . . 0.0 113.03 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -42.31 84.37 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.75 0.705 . . . . 0.0 110.193 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -66.08 -36.21 82.59 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 120.999 -1.063 . . . . 0.0 112.569 174.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.56 -44.51 96.08 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.711 1.141 . . . . 0.0 108.753 172.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.99 96.55 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.511 177.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.13 -46.17 90.54 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 119.937 1.244 . . . . 0.0 110.437 177.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 38.9 m0 -64.72 -14.1 57.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 120.653 -1.28 . . . . 0.0 112.099 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 704' ' ' LYS . . . . . 0.489 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.5 OUTLIER -103.64 -17.33 15.19 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 117.749 -1.119 . . . . 0.0 112.51 168.795 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 80.7 mtm-85 -69.72 -40.68 76.09 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 121.41 1.914 . . . . 0.0 109.244 169.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 20.7 p -77.21 29.79 0.14 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.075 1.75 . . . . 0.0 113.244 -169.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.642 0 N-CA-C 108.763 -1.735 . . . . 0.0 108.763 -170.6 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 N--CA 1.46 -0.475 0 N-CA-C 118.91 2.619 . . . . 0.0 118.91 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 67.6 m -160.17 -40.27 0.05 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.751 1.159 . . . . 0.0 110.815 177.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -77.55 -63.09 1.46 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.318 1.447 . . . . 0.0 109.343 176.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 1.4 pt -61.71 116.91 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 C-N-CA 125.49 1.516 . . . . 0.0 110.728 -172.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.53 157.83 63.97 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 168.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -56.72 -42.56 63.69 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.573 2.182 . . . . 0.0 111.093 -169.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -63.86 -43.53 95.81 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 123.728 0.642 . . . . 0.0 110.003 -176.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 15.6 t -65.94 -36.89 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.752 0.821 . . . . 0.0 109.785 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -64.37 -37.9 89.13 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.429 -0.794 . . . . 0.0 111.19 174.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -81.47 -14.38 57.08 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 118.933 0.788 . . . . 0.0 112.658 -178.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -73.63 -16.16 61.24 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.991 1.317 . . . . 0.0 110.723 169.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 81.1 mt -66.97 150.82 97.67 Favored Pre-proline 0 CA--C 1.533 0.306 0 O-C-N 121.521 -0.737 . . . . 0.0 109.186 171.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -54.97 142.46 76.16 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.372 2.048 . . . . 0.0 110.33 173.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.89 -35.68 61.87 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.984 0.914 . . . . 0.0 112.178 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -72.47 -28.66 63.05 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 61.2 t -70.68 -37.46 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 172.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -62.26 -50.37 72.01 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -176.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -49.18 -48.24 45.31 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.79 1.236 . . . . 0.0 113.363 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -41.74 96.33 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 118.527 0.603 . . . . 0.0 110.412 -179.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.98 -32.52 73.88 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.151 -0.968 . . . . 0.0 111.948 175.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.34 -40.35 97.05 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 119.734 1.152 . . . . 0.0 109.885 171.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.12 -34.32 70.95 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.257 176.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.39 -51.71 61.84 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 124.377 1.071 . . . . 0.0 109.598 176.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 21.2 m0 -59.94 -46.31 89.81 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 175.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.6 tptp -69.16 -11.35 60.72 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 120.357 1.435 . . . . 0.0 113.771 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -104.14 5.0 34.73 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 121.417 1.917 . . . . 0.0 111.821 172.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 29.5 p -124.42 -14.96 6.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.56 0.744 . . . . 0.0 112.202 174.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 N-CA-C 106.9 -2.48 . . . . 0.0 106.9 170.352 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo . . . . . 0 CA--C 1.537 0.653 0 CA-C-O 122.394 0.914 . . . . 0.0 113.613 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 2.3 m -48.82 -37.84 20.47 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.446 1.498 . . . . 0.0 114.331 -169.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -79.75 -70.34 0.52 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.503 1.521 . . . . 0.0 110.887 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 1.5 pt -62.04 117.25 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 C-N-CA 125.739 1.615 . . . . 0.0 110.846 -170.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.14 160.43 62.9 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 169.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -58.96 -38.29 88.88 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.419 2.079 . . . . 0.0 111.563 -174.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -56.92 -54.62 44.49 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 124.011 0.819 . . . . 0.0 110.019 175.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 11.2 t -65.33 -33.59 64.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 C-N-CA 123.015 0.526 . . . . 0.0 109.618 -174.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.427 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 75.7 t80 -68.44 -39.42 81.53 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.985 -0.447 . . . . 0.0 112.139 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -84.34 -16.94 41.12 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.904 0.774 . . . . 0.0 111.653 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -71.81 -13.93 61.83 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.687 1.195 . . . . 0.0 110.41 169.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.02 151.97 96.55 Favored Pre-proline 0 CA--C 1.536 0.408 0 O-C-N 121.436 -0.79 . . . . 0.0 109.349 169.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -55.03 144.12 70.24 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.421 2.08 . . . . 0.0 110.091 175.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -30.87 -63.84 0.14 Allowed 'General case' 0 C--O 1.232 0.146 0 C-N-CA 126.922 2.089 . . . . 0.0 111.328 175.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.58 -23.94 64.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -172.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 80.6 t -69.48 -36.25 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 119.17 0.895 . . . . 0.0 109.374 173.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.427 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 59.6 mt-30 -65.93 -46.32 78.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -67.83 -41.92 82.27 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 114.381 -1.281 . . . . 0.0 109.325 -175.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -65.63 -41.36 92.75 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 119.094 -0.479 . . . . 0.0 110.884 176.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -36.29 83.9 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 119.563 1.074 . . . . 0.0 110.696 177.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 44.6 mt -67.42 -41.54 84.68 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.835 0.743 . . . . 0.0 110.204 174.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.46 -37.13 86.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.281 0.491 . . . . 0.0 110.672 173.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -63.88 -55.19 24.59 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.654 1.182 . . . . 0.0 108.315 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -65.85 -7.84 18.59 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.329 -0.857 . . . . 0.0 112.877 175.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . 0.498 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -107.74 2.5 23.74 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.324 169.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -119.34 -2.72 10.57 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.667 1.187 . . . . 0.0 112.364 169.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.9 p -115.84 -7.35 12.05 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.48 1.512 . . . . 0.0 110.962 173.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.882 0 C-N-CA 130.217 3.77 . . . . 0.0 104.072 169.567 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_exo . . . . . 0 N--CA 1.457 -0.638 0 CA-C-O 118.608 -0.663 . . . . 0.0 113.091 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 11.2 m 46.99 26.39 0.59 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.481 1.512 . . . . 0.0 114.779 169.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . 0.267 23.5 t0 51.99 32.63 10.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.719 2.008 . . . . 0.0 114.471 -174.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . 0.401 HG21 HD13 ' A' ' 683' ' ' ILE . 22.9 mt -70.52 173.61 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 168.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.41 147.47 37.1 Favored Pre-proline 0 C--N 1.321 -0.646 0 N-CA-C 105.836 -1.912 . . . . 0.0 105.836 169.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -65.33 -34.91 42.61 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 CA-C-N 120.775 1.313 . . . . 0.0 111.549 -169.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -65.61 -48.65 71.54 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 176.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 49.4 t -55.05 -33.71 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 123.5 0.72 . . . . 0.0 110.224 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 65.6 t80 -75.52 -47.99 24.5 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 178.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -78.56 -11.95 59.99 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.032 -1.043 . . . . 0.0 111.728 -175.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -70.53 -20.47 62.81 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.085 1.354 . . . . 0.0 109.751 168.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 73.3 mt -65.6 151.52 94.41 Favored Pre-proline 0 CA--C 1.533 0.297 0 O-C-N 121.393 -0.817 . . . . 0.0 109.47 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_exo -54.39 146.88 49.37 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.222 2.615 . . . . 0.0 110.031 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.3 tp10 -47.63 -49.5 26.98 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.553 0.741 . . . . 0.0 112.021 -173.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -66.78 -30.45 70.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 93.3 t -68.14 -39.3 81.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 175.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.417 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 73.6 mt-30 -64.07 -45.13 90.14 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 122.315 1.055 . . . . 0.0 108.214 -178.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.08 -52.42 65.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.42 -1.263 . . . . 0.0 109.917 -178.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -64.64 -36.74 85.23 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 118.941 0.791 . . . . 0.0 111.599 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -38.61 86.18 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.018 0.826 . . . . 0.0 110.33 177.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 31.0 mt -68.49 -38.07 80.66 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 119.546 1.066 . . . . 0.0 110.42 174.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.49 -38.84 92.69 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.685 0.675 . . . . 0.0 110.242 173.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.27 -55.33 33.18 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 124.164 0.985 . . . . 0.0 108.775 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -67.16 -6.22 16.88 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.088 -1.007 . . . . 0.0 112.841 177.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . 0.501 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -110.3 3.01 19.5 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.402 1.001 . . . . 0.0 112.903 170.321 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -117.96 -9.55 10.57 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.528 1.131 . . . . 0.0 112.319 169.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.5 p -108.87 -5.68 16.09 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.465 1.506 . . . . 0.0 111.518 173.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.271 0 N-CA-C 104.32 -3.512 . . . . 0.0 104.32 169.461 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo . . . . . 0 CA--C 1.545 1.064 0 CA-C-O 121.559 0.566 . . . . 0.0 112.243 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 12.9 m -145.64 9.0 1.17 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.191 -1.568 . . . . 0.0 112.942 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -77.37 -0.65 26.5 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.704 1.602 . . . . 0.0 111.933 169.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 8.8 pt -145.05 163.14 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 C-N-CA 127.436 2.294 . . . . 0.0 108.479 -172.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.75 150.42 37.71 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 125.331 1.452 . . . . 0.0 107.207 170.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -66.53 -37.48 22.38 Favored 'Trans proline' 0 N--CA 1.452 -0.957 0 C-N-CA 123.0 2.466 . . . . 0.0 113.413 -173.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 19.5 mm100 -68.25 -46.66 69.87 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 86.1 t -56.37 -40.51 67.26 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -64.26 -52.71 57.34 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 173.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -69.33 -26.13 64.55 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.572 1.078 . . . . 0.0 111.569 -171.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -71.13 -7.82 49.24 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.818 1.647 . . . . 0.0 112.461 171.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 51.6 mt -65.07 153.83 88.16 Favored Pre-proline 0 CA--C 1.537 0.47 0 O-C-N 120.746 -1.221 . . . . 0.0 109.62 169.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -53.63 142.45 60.73 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.405 2.737 . . . . 0.0 109.851 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -48.75 -41.51 32.41 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 123.683 0.793 . . . . 0.0 112.786 -172.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -73.65 -31.69 63.62 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 72.8 t -66.2 -48.17 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 170.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -55.03 -43.56 73.83 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 123.854 0.862 . . . . 0.0 110.919 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.41 -45.41 91.11 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 117.537 -1.22 . . . . 0.0 110.459 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -71.02 -39.92 72.06 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.742 1.156 . . . . 0.0 111.342 -177.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . 0.505 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 0.8 OUTLIER -64.36 -44.97 89.76 Favored 'General case' 0 C--O 1.226 -0.163 0 O-C-N 121.47 -0.769 . . . . 0.0 110.974 175.332 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 61.3 mt -58.15 -39.86 79.88 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 119.147 0.885 . . . . 0.0 109.821 173.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -64.92 -44.67 88.77 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 117.412 -1.28 . . . . 0.0 111.089 178.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.98 -50.48 64.04 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.639 1.563 . . . . 0.0 108.825 172.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . 0.505 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 49.6 m0 -68.23 -9.04 44.29 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.026 1.33 . . . . 0.0 113.532 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -110.31 -3.36 16.25 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.734 0.814 . . . . 0.0 112.182 169.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -91.32 -6.61 52.81 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.208 0.913 . . . . 0.0 109.509 168.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 54.4 p -131.08 4.63 4.44 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 114.131 1.159 . . . . 0.0 114.131 -169.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 N-CA-C 106.312 -2.715 . . . . 0.0 106.312 -176.052 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo . . . . . 0 CA--C 1.535 0.537 0 N-CA-C 114.906 1.079 . . . . 0.0 114.906 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.7 m -40.6 -39.33 1.03 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.651 1.98 . . . . 0.0 116.32 -169.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 16.4 p-10 -82.27 -69.05 0.65 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.972 1.309 . . . . 0.0 110.517 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.5 pt -62.38 160.46 2.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 125.807 1.643 . . . . 0.0 112.577 -172.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.57 166.48 20.66 Favored Pre-proline 0 N--CA 1.464 0.257 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 169.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -54.81 -37.99 92.24 Favored 'Trans proline' 0 CA--C 1.505 -0.973 0 C-N-CA 122.553 2.169 . . . . 0.0 113.725 -168.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -61.6 -54.84 37.58 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 13.9 t -65.89 -34.18 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 124.471 1.108 . . . . 0.0 109.811 -173.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 66.6 t80 -72.31 -37.4 68.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 122.906 0.482 . . . . 0.0 111.848 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -83.07 -16.86 45.28 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.547 0.612 . . . . 0.0 111.301 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -71.56 -12.55 61.42 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.544 1.138 . . . . 0.0 110.872 169.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 69.7 mt -73.61 152.44 89.5 Favored Pre-proline 0 CA--C 1.539 0.538 0 O-C-N 121.313 -0.867 . . . . 0.0 109.766 174.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -56.47 155.64 24.92 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 123.194 2.596 . . . . 0.0 111.528 172.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -42.07 46.9 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.527 0.731 . . . . 0.0 110.81 176.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -62.11 -53.46 55.16 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 -176.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 41.3 t -60.15 -32.47 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.476 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.9 mt-30 -68.84 -55.9 9.69 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 120.071 1.305 . . . . 0.0 108.606 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . 0.414 ' HE3' ' HB3' ' A' ' 697' ' ' LYS 0.335 0.0 OUTLIER -74.24 -30.79 62.32 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.248 -169.404 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -68.23 -39.97 82.15 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 119.671 1.123 . . . . 0.0 109.101 170.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -36.94 85.72 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.561 1.073 . . . . 0.0 110.116 174.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 15.1 mt -62.47 -42.26 99.36 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 119.114 0.87 . . . . 0.0 110.143 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.0 -42.17 81.15 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.869 0.759 . . . . 0.0 110.827 178.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -59.26 -53.19 61.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.142 1.377 . . . . 0.0 109.454 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -66.88 -32.15 73.22 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 118.408 -0.806 . . . . 0.0 110.923 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . 0.42 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -60.72 -25.94 66.81 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 119.566 1.075 . . . . 0.0 111.829 174.254 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -64.44 -12.39 43.01 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.963 1.256 . . . . 0.0 113.543 170.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 1.9 p -130.17 -17.36 3.45 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -169.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 N-CA-C 105.903 -2.879 . . . . 0.0 105.903 176.375 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo . . . . . 0 CA--C 1.537 0.637 0 CA-C-O 121.15 0.396 . . . . 0.0 112.288 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 2.2 m -45.96 -39.34 8.8 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 114.781 1.401 . . . . 0.0 114.781 -168.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 11.7 p-10 -66.15 -85.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.885 2.074 . . . . 0.0 111.021 173.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . 0.407 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 4.0 pt -55.16 118.21 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 C-N-CA 125.533 1.533 . . . . 0.0 110.107 -169.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.6 152.78 67.34 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 170.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -57.38 -37.17 98.32 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.163 2.575 . . . . 0.0 111.771 -169.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . 0.428 ' CD ' ' H ' ' A' ' 686' ' ' GLN . 2.5 mp0 -56.41 -55.37 34.37 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 5.2 t -60.82 -37.28 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 C-N-CA 124.532 1.133 . . . . 0.0 109.607 -176.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 72.0 t80 -69.61 -40.76 76.43 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 119.068 -0.491 . . . . 0.0 112.029 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -77.0 -20.29 56.23 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.456 1.026 . . . . 0.0 111.281 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -70.52 -11.22 60.79 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.282 1.033 . . . . 0.0 111.524 169.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 83.1 mt -70.59 152.32 95.34 Favored Pre-proline 0 CA--C 1.535 0.379 0 O-C-N 121.057 -1.027 . . . . 0.0 109.139 169.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -53.98 147.34 43.25 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.464 2.109 . . . . 0.0 110.162 175.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -40.95 -57.51 1.97 Allowed 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.069 1.348 . . . . 0.0 111.05 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.01 -25.04 63.4 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -173.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 78.9 t -67.31 -45.14 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 62.9 mt-30 -55.53 -43.24 75.59 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.249 0.547 . . . . 0.0 109.645 178.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -74.21 -40.75 62.25 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.218 -173.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -62.99 -40.08 96.7 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 119.219 0.918 . . . . 0.0 110.862 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.3 -38.61 91.65 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 119.468 1.031 . . . . 0.0 111.272 177.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.19 -44.38 84.15 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.923 0.783 . . . . 0.0 110.116 174.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.13 82.9 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 119.148 -0.453 . . . . 0.0 110.58 174.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.75 -54.83 33.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.463 1.105 . . . . 0.0 108.113 178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 22.1 m0 -65.73 -2.84 4.0 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.285 1.034 . . . . 0.0 113.045 176.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -117.13 5.06 12.71 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.861 1.209 . . . . 0.0 113.759 169.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 19.1 ptt180 -117.93 9.46 12.84 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.638 1.175 . . . . 0.0 111.461 169.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 28.8 p -125.9 -3.56 7.06 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.206 1.402 . . . . 0.0 111.884 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.577 0 N-CA-C 105.388 -3.085 . . . . 0.0 105.388 -172.645 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo . . . . . 0 CA--C 1.54 0.814 0 N-CA-C 114.826 1.048 . . . . 0.0 114.826 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 4.2 m -60.67 -30.3 69.83 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.418 1.087 . . . . 0.0 113.539 -172.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -69.06 -9.94 55.07 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.848 2.459 . . . . 0.0 114.111 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 13.1 pt -145.82 -178.24 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 125.549 1.54 . . . . 0.0 108.323 -174.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -152.03 162.75 25.73 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 168.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -57.51 -36.71 98.65 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.213 1.942 . . . . 0.0 113.577 -168.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -62.37 -53.46 54.71 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -177.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 4.1 t -68.73 -33.19 58.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.748 -173.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.47 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 66.6 t80 -65.73 -39.39 91.09 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 118.391 0.541 . . . . 0.0 111.161 177.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -81.4 -16.6 51.67 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.68 -0.638 . . . . 0.0 111.551 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -75.18 -13.22 60.44 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.168 0.894 . . . . 0.0 110.832 169.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 64.6 mt -68.84 152.32 96.82 Favored Pre-proline 0 C--N 1.344 0.357 0 O-C-N 121.075 -1.016 . . . . 0.0 109.216 170.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -53.65 144.74 51.74 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.382 2.055 . . . . 0.0 110.745 173.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.05 -34.35 65.82 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.598 0.759 . . . . 0.0 112.791 -176.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.5 -38.78 74.38 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.701 -0.624 . . . . 0.0 112.49 173.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 96.2 t -61.53 -37.11 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 O-C-N 120.88 -1.137 . . . . 0.0 109.559 175.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.47 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 68.5 mt-30 -58.52 -53.93 52.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -51.75 -52.44 48.65 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.19 -36.14 79.11 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -171.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.03 -38.67 89.59 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.495 171.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.75 -38.35 87.66 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-N 119.425 1.012 . . . . 0.0 110.343 173.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.47 72.67 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.561 0.619 . . . . 0.0 110.901 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -60.44 -52.28 65.9 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 176.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.4 m0 -58.61 -46.1 87.75 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 118.531 -0.747 . . . . 0.0 110.06 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -68.13 -19.56 64.83 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 120.405 1.457 . . . . 0.0 112.643 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -84.87 -4.68 59.2 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 120.692 1.587 . . . . 0.0 113.083 169.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 37.5 p -126.3 -15.26 5.74 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.165 1.348 . . . . 0.0 112.325 -171.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.975 0 N-CA-C 106.282 -2.727 . . . . 0.0 106.282 169.869 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo . . . . . 0 CA--C 1.536 0.621 0 N-CA-C 114.869 1.065 . . . . 0.0 114.869 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 5.0 m -55.55 -27.37 48.59 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.173 1.545 . . . . 0.0 115.173 -169.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -91.03 -7.78 50.91 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.615 1.966 . . . . 0.0 113.512 -172.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.3 pt -140.05 170.27 15.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 125.72 1.608 . . . . 0.0 108.569 -174.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -151.82 170.04 8.53 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 168.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -54.58 -37.12 90.64 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.056 1.837 . . . . 0.0 113.062 -168.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -61.6 -55.73 27.58 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.47 -36.51 76.54 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 C-N-CA 124.833 1.253 . . . . 0.0 109.93 -172.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.416 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 52.6 t80 -73.49 -37.58 65.68 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.836 -0.54 . . . . 0.0 111.315 -178.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -81.36 -16.17 53.09 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.805 -0.559 . . . . 0.0 110.936 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -73.3 -13.43 61.12 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.343 1.057 . . . . 0.0 110.762 169.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 69.2 mt -73.72 152.86 89.34 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.142 -0.974 . . . . 0.0 109.108 172.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -54.69 142.54 72.75 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.076 1.851 . . . . 0.0 110.611 172.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.63 -33.91 64.45 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.583 0.753 . . . . 0.0 112.098 -179.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -72.45 -30.51 64.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.341 -0.849 . . . . 0.0 113.205 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 64.4 t -69.0 -42.44 82.11 Favored 'Isoleucine or valine' 0 C--O 1.23 0.051 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 172.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.416 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 73.8 mt-30 -54.82 -49.87 69.97 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -54.39 -46.98 73.19 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 175.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.62 -40.25 95.15 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.625 0.648 . . . . 0.0 110.499 -177.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . 0.408 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 0.2 OUTLIER -62.86 -32.65 73.93 Favored 'General case' 0 C--N 1.332 -0.152 0 C-N-CA 124.224 1.01 . . . . 0.0 111.375 175.689 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 18.8 mt -65.7 -41.54 92.24 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 120.066 1.303 . . . . 0.0 110.261 170.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.78 -38.35 90.76 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.45 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -59.58 -55.3 36.25 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 119.103 0.865 . . . . 0.0 109.43 173.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . 0.408 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 20.1 m0 -71.62 4.87 2.77 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.214 -0.929 . . . . 0.0 112.638 177.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . 0.473 ' HZ2' ' C ' ' A' ' 707' ' ' GLY 0.266 1.2 tppm? -124.4 10.79 8.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.588 1.155 . . . . 0.0 112.617 169.064 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -122.51 4.99 9.59 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.815 1.246 . . . . 0.0 110.98 168.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 32.5 p -121.6 -6.91 9.17 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.453 1.501 . . . . 0.0 111.656 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . 0.473 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.245 0.831 0 N-CA-C 105.531 -3.028 . . . . 0.0 105.531 -176.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo . . . . . 0 CA--C 1.546 1.101 0 CA-C-O 120.769 0.237 . . . . 0.0 111.636 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 70.3 p -135.38 49.24 2.19 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.589 1.156 . . . . 0.0 109.248 -176.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.4 -58.39 0.13 Allowed 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.396 1.078 . . . . 0.0 109.383 -169.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 12.8 pt -69.93 128.97 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 123.565 0.746 . . . . 0.0 109.025 169.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -73.83 139.62 77.13 Favored Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 168.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.83 -37.09 97.66 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.698 2.266 . . . . 0.0 112.017 -174.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -68.88 -41.19 78.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.069 -0.491 . . . . 0.0 109.68 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 99.7 t -62.41 -40.74 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.466 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 84.5 t80 -62.45 -40.17 95.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 121.344 -0.847 . . . . 0.0 112.376 173.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -76.91 -10.86 59.65 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.488 -0.758 . . . . 0.0 111.998 -178.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -72.98 -21.27 60.87 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.502 1.047 . . . . 0.0 110.3 168.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 83.7 mt -61.25 151.16 77.24 Favored Pre-proline 0 CA--C 1.536 0.409 0 O-C-N 121.092 -1.005 . . . . 0.0 109.658 175.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -54.06 148.05 41.09 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 123.12 2.547 . . . . 0.0 110.981 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -34.06 -62.89 0.3 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 126.367 1.867 . . . . 0.0 111.331 176.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.48 -27.45 64.22 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -172.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 72.7 t -64.97 -45.62 94.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 174.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.466 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 60.1 mt-30 -56.84 -49.59 74.98 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -67.21 -33.04 74.52 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 116.93 -1.51 . . . . 0.0 111.893 -169.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -67.1 -50.5 61.38 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.244 1.384 . . . . 0.0 109.706 172.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -59.0 -38.74 79.9 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.396 0.998 . . . . 0.0 111.652 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 45.5 mt -67.99 -43.49 78.79 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.719 0.808 . . . . 0.0 109.994 176.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.25 -28.47 66.34 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.635 -0.698 . . . . 0.0 111.515 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -66.87 -61.35 2.0 Allowed 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 170.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.3 m0 -57.89 -20.55 37.66 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 117.339 -1.315 . . . . 0.0 112.071 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 4.2 mmpm? -89.28 -34.22 16.67 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 122.252 2.296 . . . . 0.0 112.794 169.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 7.5 ptp85 -65.64 -19.86 66.08 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 120.871 1.669 . . . . 0.0 110.744 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 24.3 p -106.38 21.33 17.58 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.788 1.235 . . . . 0.0 111.982 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 CA-C-O 118.358 -1.246 . . . . 0.0 110.258 175.023 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.271 0.0 OUTLIER . . . . . 0 N--CA 1.463 -0.305 0 N-CA-C 119.669 2.911 . . . . 0.0 119.669 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 59.1 m -160.91 -41.67 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 120.071 1.305 . . . . 0.0 110.463 172.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 19.2 p-10 -81.15 -61.54 1.92 Allowed 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.946 1.698 . . . . 0.0 109.217 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 3.4 pt -62.33 156.66 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 125.249 1.419 . . . . 0.0 111.605 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -137.94 165.85 30.56 Favored Pre-proline 0 C--N 1.329 -0.298 0 C-N-CA 126.803 2.041 . . . . 0.0 105.898 172.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -58.33 -36.32 97.76 Favored 'Trans proline' 0 CA--C 1.508 -0.775 0 C-N-CA 123.089 2.526 . . . . 0.0 113.795 -168.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -62.36 -54.7 36.55 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 17.8 t -60.08 -39.47 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.073 0 C-N-CA 124.981 1.312 . . . . 0.0 109.25 -174.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 68.7 t80 -70.52 -39.32 74.14 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.808 -177.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -82.84 -16.23 48.49 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.032 0.833 . . . . 0.0 111.234 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -71.24 -11.66 61.04 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.529 1.131 . . . . 0.0 110.656 168.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 53.6 mt -76.5 152.4 83.41 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 124.027 0.931 . . . . 0.0 109.284 171.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -56.2 146.99 68.44 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.944 2.429 . . . . 0.0 110.947 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -46.76 -49.91 18.99 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.075 0.95 . . . . 0.0 112.003 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.55 -28.28 67.66 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -177.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 81.8 t -69.48 -36.93 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 CA-C-N 118.747 0.703 . . . . 0.0 109.493 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 70.7 mt-30 -65.38 -46.45 80.05 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.231 1.015 . . . . 0.0 108.365 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -50.26 74.54 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.607 178.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.82 -39.52 90.94 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 123.32 0.648 . . . . 0.0 111.515 -175.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -40.81 95.67 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 121.283 -0.885 . . . . 0.0 109.81 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 40.3 mt -65.36 -41.14 94.12 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.085 0.857 . . . . 0.0 110.409 174.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.74 -40.7 93.4 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.963 -0.542 . . . . 0.0 110.446 175.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.28 -54.86 38.64 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.014 0.925 . . . . 0.0 108.824 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -67.46 0.8 2.7 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.347 1.059 . . . . 0.0 113.066 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -122.14 7.16 9.71 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.425 1.011 . . . . 0.0 113.19 169.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -118.4 13.28 13.54 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.563 1.145 . . . . 0.0 111.52 170.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 23.3 p -129.92 -7.12 4.46 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.235 1.414 . . . . 0.0 111.958 -176.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.947 0 N-CA-C 104.332 -3.507 . . . . 0.0 104.332 -169.866 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo . . . . . 0 N--CA 1.457 -0.656 0 CA-C-O 121.708 0.628 . . . . 0.0 113.668 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.3 m -44.13 -41.55 5.73 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.711 1.604 . . . . 0.0 114.847 -169.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -69.74 -81.37 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.289 2.236 . . . . 0.0 112.084 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.7 pt -53.08 114.14 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 C-N-CA 127.212 2.205 . . . . 0.0 112.842 -169.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.9 145.44 98.92 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 168.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -59.48 -31.63 94.99 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.075 1.85 . . . . 0.0 112.142 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -66.51 -45.87 78.1 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 45.0 t -59.96 -42.36 89.2 Favored 'Isoleucine or valine' 0 C--N 1.342 0.281 0 C-N-CA 123.642 0.777 . . . . 0.0 109.435 174.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -62.25 -39.64 93.52 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.544 -176.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -82.28 -16.09 50.68 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.19 0.904 . . . . 0.0 112.334 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -71.28 -23.3 61.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.497 0.719 . . . . 0.0 110.346 169.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 85.5 mt -58.69 147.17 72.05 Favored Pre-proline 0 CA--C 1.538 0.482 0 O-C-N 121.115 -0.991 . . . . 0.0 109.604 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -54.92 147.78 50.21 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.457 2.105 . . . . 0.0 110.476 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -49.46 -48.31 47.68 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.481 0.712 . . . . 0.0 111.466 -175.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.37 -26.24 64.57 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.707 1.002 . . . . 0.0 113.707 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 69.7 t -71.4 -37.97 66.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 118.889 0.768 . . . . 0.0 109.277 172.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.36 -47.45 79.27 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 122.565 1.174 . . . . 0.0 107.849 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.03 -46.35 91.06 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.276 -1.329 . . . . 0.0 109.893 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.79 -39.88 91.39 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 118.733 0.697 . . . . 0.0 111.138 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -40.23 96.58 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.198 0.908 . . . . 0.0 110.396 175.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 47.5 mt -66.9 -39.81 87.52 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.463 -0.773 . . . . 0.0 110.528 175.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.87 -38.45 91.15 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.606 0.639 . . . . 0.0 110.512 174.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -62.19 -54.57 39.09 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.694 1.197 . . . . 0.0 108.428 177.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.5 m0 -66.5 -6.6 15.43 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.246 -0.909 . . . . 0.0 113.225 176.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -108.96 1.56 20.75 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 117.979 -1.01 . . . . 0.0 113.06 169.735 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -117.92 -3.08 11.2 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.751 1.221 . . . . 0.0 112.661 169.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.7 p -116.16 -8.12 11.79 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.578 1.551 . . . . 0.0 110.973 174.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.458 0 C-N-CA 130.099 3.714 . . . . 0.0 104.091 169.624 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo . . . . . 0 CA--C 1.533 0.432 0 N-CA-C 115.853 1.444 . . . . 0.0 115.853 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 29.0 m 115.11 -6.35 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 130.971 3.709 . . . . 0.0 109.916 -170.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -68.7 -13.72 62.55 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.507 1.923 . . . . 0.0 111.019 168.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . 0.425 HD12 ' CD1' ' A' ' 688' ' ' PHE . 10.1 pt -135.2 146.57 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.992 0 C-N-CA 127.258 2.223 . . . . 0.0 109.342 -176.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -91.23 143.89 29.02 Favored Pre-proline 0 CA--C 1.541 0.615 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 167.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -57.62 -40.38 80.51 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.718 2.279 . . . . 0.0 112.561 -174.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -68.35 -43.85 76.53 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.38 -40.52 88.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 84.2 t80 -58.66 -38.64 78.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 121.681 -0.637 . . . . 0.0 112.096 176.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -80.68 -15.91 55.34 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.858 0.754 . . . . 0.0 112.727 -179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -73.36 -19.97 60.88 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.333 0.97 . . . . 0.0 110.813 169.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.77 148.82 66.82 Favored Pre-proline 0 CA--C 1.536 0.411 0 O-C-N 120.905 -1.122 . . . . 0.0 109.463 172.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -54.34 147.29 46.99 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 122.483 2.122 . . . . 0.0 110.576 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . 0.431 ' CD ' ' HZ3' ' A' ' 697' ' ' LYS . 45.1 tp10 -38.11 -58.56 0.95 Allowed 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 125.461 1.504 . . . . 0.0 110.945 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.83 -25.09 62.68 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -173.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.41 -43.47 87.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 119.351 0.978 . . . . 0.0 108.595 173.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.458 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 66.7 mt-30 -57.49 -45.5 84.83 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . 0.431 ' HZ3' ' CD ' ' A' ' 693' ' ' GLU . 11.5 mptt -71.78 -33.89 68.98 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.529 -174.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -66.63 -46.45 75.79 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.324 1.05 . . . . 0.0 111.213 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.63 -43.08 99.52 Favored 'General case' 0 N--CA 1.461 0.097 0 O-C-N 121.412 -0.805 . . . . 0.0 110.168 177.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.01 -41.07 91.33 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.928 -0.482 . . . . 0.0 111.008 172.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -59.48 -48.14 82.79 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 117.666 -1.159 . . . . 0.0 109.806 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -62.05 -45.63 92.72 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 120.348 1.431 . . . . 0.0 111.449 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 31.1 m0 -63.62 -14.13 48.74 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 120.501 -1.374 . . . . 0.0 112.506 175.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.6 OUTLIER -101.74 -17.85 16.08 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.726 1.211 . . . . 0.0 112.928 169.56 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -67.77 -41.29 83.5 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 121.412 1.915 . . . . 0.0 109.033 171.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 17.7 p -73.38 24.33 0.07 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.913 2.085 . . . . 0.0 113.539 -172.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 -172.26 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.279 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.42 0 N-CA-C 118.664 2.524 . . . . 0.0 118.664 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 69.0 m -158.76 -39.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.785 1.175 . . . . 0.0 110.507 177.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . 0.447 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 19.0 p-10 -75.75 -74.22 0.23 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.541 1.536 . . . . 0.0 108.688 171.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . 0.447 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 6.2 pt -58.44 156.53 2.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 C-N-CA 126.422 1.889 . . . . 0.0 111.681 -176.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -141.68 169.9 10.28 Favored Pre-proline 0 C--N 1.331 -0.201 0 C-N-CA 125.786 1.634 . . . . 0.0 106.806 169.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -55.29 -36.2 93.06 Favored 'Trans proline' 0 CA--C 1.506 -0.905 0 C-N-CA 122.567 2.178 . . . . 0.0 113.81 -168.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -63.14 -56.08 19.81 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 11.9 t -61.78 -37.39 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 C-N-CA 124.305 1.042 . . . . 0.0 109.546 -173.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 75.8 t80 -75.32 -40.83 58.02 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 123.345 0.658 . . . . 0.0 111.341 -176.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -82.05 -14.1 56.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.059 0.845 . . . . 0.0 110.934 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -74.36 -9.67 58.83 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.834 1.254 . . . . 0.0 110.325 168.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 54.3 mt -76.34 152.92 83.96 Favored Pre-proline 0 CA--C 1.534 0.339 0 O-C-N 121.499 -0.751 . . . . 0.0 109.144 170.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -55.6 146.7 63.23 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.755 2.303 . . . . 0.0 110.653 177.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -46.39 -49.81 17.44 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 124.249 1.02 . . . . 0.0 111.943 -176.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.46 -28.12 66.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.316 -0.85 . . . . 0.0 113.237 -177.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 90.6 t -68.93 -38.05 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 118.922 0.783 . . . . 0.0 109.406 172.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.43 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 72.8 mt-30 -63.99 -47.7 79.33 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 -178.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.58 -46.54 89.85 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.08 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -62.66 -43.11 99.64 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.11 0.964 . . . . 0.0 111.63 -178.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.0 -39.27 90.16 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.385 0.674 . . . . 0.0 110.247 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 36.0 mt -63.4 -41.37 98.75 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 118.909 0.777 . . . . 0.0 110.243 172.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.75 97.78 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.958 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -61.35 -47.09 87.49 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 119.371 0.987 . . . . 0.0 110.825 177.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 25.0 m0 -68.93 0.05 4.96 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.315 -0.866 . . . . 0.0 112.618 173.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . 0.513 ' HZ2' ' C ' ' A' ' 707' ' ' GLY . 1.2 tppm? -117.56 3.66 12.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.358 1.463 . . . . 0.0 112.175 168.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -95.17 -11.4 28.17 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.911 1.285 . . . . 0.0 109.53 168.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 17.1 p -122.58 -3.68 8.79 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.565 1.146 . . . . 0.0 113.69 -168.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . 0.513 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.251 1.162 0 N-CA-C 106.158 -2.777 . . . . 0.0 106.158 -175.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo . . . . . 0 CA--C 1.537 0.634 0 N-CA-C 113.642 0.593 . . . . 0.0 113.642 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . 0.258 26.6 m 76.06 8.0 3.54 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 127.152 2.181 . . . . 0.0 113.291 174.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -74.76 -40.05 61.43 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 167.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 14.1 pt -76.0 127.22 37.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 127.204 2.202 . . . . 0.0 107.92 168.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -72.49 141.6 83.08 Favored Pre-proline 0 CA--C 1.543 0.677 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 167.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.84 -37.47 96.2 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.499 2.133 . . . . 0.0 112.057 -173.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -69.26 -42.75 75.15 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 64.9 t -59.75 -40.15 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 C-N-CA 123.359 0.664 . . . . 0.0 109.455 176.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.442 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 74.4 t80 -62.7 -42.41 99.63 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.378 -0.826 . . . . 0.0 112.016 176.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -75.96 -12.03 60.07 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.941 0.791 . . . . 0.0 112.182 -178.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -73.43 -20.75 60.64 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.446 1.021 . . . . 0.0 110.12 168.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 87.3 mt -60.07 151.04 67.84 Favored Pre-proline 0 CA--C 1.536 0.439 0 O-C-N 120.885 -1.134 . . . . 0.0 109.205 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -54.93 148.06 48.93 Favored 'Trans proline' 0 N--CA 1.452 -0.935 0 C-N-CA 122.607 2.205 . . . . 0.0 110.446 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . 0.459 ' CD ' ' HZ3' ' A' ' 697' ' ' LYS . 45.8 tp10 -41.32 -57.47 2.13 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.055 1.342 . . . . 0.0 111.262 -179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.8 -27.96 66.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -174.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 98.9 t -67.76 -45.1 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 176.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.442 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 70.0 mt-30 -55.36 -44.5 76.06 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 122.024 0.916 . . . . 0.0 109.318 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . 0.459 ' HZ3' ' CD ' ' A' ' 693' ' ' GLU . 9.1 mptt -69.87 -41.37 74.9 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 117.622 -1.18 . . . . 0.0 110.347 -171.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -69.9 -43.77 71.07 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 119.614 1.097 . . . . 0.0 111.022 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -56.39 -46.56 80.06 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.877 0.762 . . . . 0.0 110.941 174.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 32.2 mt -69.03 -33.97 74.47 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.472 -0.767 . . . . 0.0 111.461 178.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.99 -34.74 73.74 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 119.257 0.935 . . . . 0.0 110.903 176.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -67.73 -51.81 44.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.349 1.06 . . . . 0.0 109.007 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -59.94 -34.09 72.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 120.965 -1.084 . . . . 0.0 110.9 176.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . 0.465 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.3 OUTLIER -74.99 -35.63 62.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 117.666 -1.159 . . . . 0.0 112.777 175.173 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -74.71 -14.02 60.68 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 120.877 1.671 . . . . 0.0 111.899 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 36.0 p -103.7 18.94 20.82 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.279 1.032 . . . . 0.0 111.938 -178.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.856 0 CA-C-O 117.188 -1.895 . . . . 0.0 108.724 179.098 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo . . . . . 0 CA--C 1.539 0.744 0 N-CA-C 116.127 1.549 . . . . 0.0 116.127 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.8 m -49.68 -29.87 8.14 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.732 1.613 . . . . 0.0 115.121 -169.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -90.15 -68.5 0.78 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.664 1.586 . . . . 0.0 110.789 177.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.5 pt -66.61 162.1 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 125.877 1.671 . . . . 0.0 113.083 -171.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -140.84 166.29 23.81 Favored Pre-proline 0 N--CA 1.468 0.467 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 169.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -56.9 -34.67 97.57 Favored 'Trans proline' 0 CA--C 1.505 -0.958 0 C-N-CA 122.533 2.156 . . . . 0.0 113.666 -168.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -63.38 -55.71 22.19 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -178.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 17.6 t -65.93 -34.46 70.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 124.218 1.007 . . . . 0.0 109.431 -173.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.431 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 79.5 t80 -70.74 -41.74 71.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 121.893 -0.504 . . . . 0.0 111.495 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -82.63 -13.75 55.93 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.232 0.924 . . . . 0.0 111.015 -179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -71.59 -17.17 62.3 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.36 1.064 . . . . 0.0 109.954 168.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 70.4 mt -66.55 152.51 94.83 Favored Pre-proline 0 C--N 1.344 0.364 0 O-C-N 121.199 -0.938 . . . . 0.0 109.765 174.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -55.06 147.12 54.92 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.023 2.482 . . . . 0.0 110.252 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -46.62 -50.74 17.11 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 124.181 0.993 . . . . 0.0 112.436 -172.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.0 93.35 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 57.8 t -61.23 -38.09 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 O-C-N 121.357 -0.839 . . . . 0.0 109.531 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.431 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 60.8 mt-30 -64.0 -48.12 77.65 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.222 0.465 . . . . 0.0 110.468 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.6 -48.53 80.52 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -176.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.51 -37.03 76.99 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 122.736 0.414 . . . . 0.0 110.344 -173.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.55 -42.53 91.75 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.829 0.741 . . . . 0.0 110.192 175.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.03 -40.68 94.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.796 0.725 . . . . 0.0 110.711 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.59 -38.23 70.89 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.57 0.623 . . . . 0.0 111.912 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 39.8 tp10 -69.42 -41.65 76.07 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.43 1.092 . . . . 0.0 110.099 -179.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -61.31 -45.33 94.91 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.185 -0.947 . . . . 0.0 109.087 170.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.5 tptp -60.83 -24.51 65.93 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.504 1.047 . . . . 0.0 112.96 176.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -73.01 -11.73 60.67 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.307 1.043 . . . . 0.0 112.166 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.57 -13.46 1.99 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -168.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.848 0 N-CA-C 105.072 -3.211 . . . . 0.0 105.072 170.188 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo . . . . . 0 CA--C 1.534 0.489 0 N-CA-C 113.441 0.516 . . . . 0.0 113.441 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 15.2 m 67.27 15.45 9.97 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.88 1.672 . . . . 0.0 113.692 173.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -76.76 -41.09 46.15 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.605 1.562 . . . . 0.0 107.577 168.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.1 pt -81.89 139.2 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 C-N-CA 128.021 2.528 . . . . 0.0 108.301 169.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -73.57 144.2 83.2 Favored Pre-proline 0 CA--C 1.542 0.66 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 168.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -60.66 -38.07 74.66 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 121.727 1.618 . . . . 0.0 111.526 -175.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -63.62 -47.39 81.61 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 58.4 t -61.71 -37.12 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -176.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 86.5 t80 -62.83 -47.49 83.2 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.389 -0.82 . . . . 0.0 112.235 171.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -74.22 -14.22 60.9 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.204 -0.935 . . . . 0.0 111.701 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -73.82 -14.54 61.11 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.676 1.19 . . . . 0.0 110.646 169.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 77.3 mt -64.77 152.74 89.64 Favored Pre-proline 0 CA--C 1.537 0.445 0 O-C-N 121.022 -1.049 . . . . 0.0 109.697 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -55.3 144.07 73.17 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.139 2.559 . . . . 0.0 109.945 177.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -44.94 -50.09 10.71 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.613 1.165 . . . . 0.0 112.079 -174.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.46 -32.3 73.05 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 97.4 t -67.11 -40.1 84.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 176.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.43 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 74.0 mt-30 -62.54 -48.67 78.51 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 -177.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -45.04 79.53 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.114 -175.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -67.5 -43.18 81.52 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.02 0.827 . . . . 0.0 111.598 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . 0.411 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 2.0 mm? -63.06 -35.98 82.07 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 120.988 -1.07 . . . . 0.0 112.249 174.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 39.9 mt -69.7 -38.2 76.88 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 177.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.48 -36.84 83.76 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.684 -0.674 . . . . 0.0 110.352 173.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -63.8 -54.08 40.8 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.528 1.131 . . . . 0.0 109.456 176.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . 0.411 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 31.3 m0 -62.36 -25.34 67.86 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 120.846 -1.159 . . . . 0.0 111.587 177.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.5 OUTLIER -81.39 -32.81 32.66 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 117.177 -1.392 . . . . 0.0 112.766 173.28 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -82.34 -27.51 32.16 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.977 1.717 . . . . 0.0 111.432 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 27.9 p -86.72 155.36 20.39 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.91 0 N-CA-C 107.422 -2.271 . . . . 0.0 107.422 168.867 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo . . . . . 0 CA--C 1.535 0.536 0 N-CA-C 116.446 1.671 . . . . 0.0 116.446 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 5.8 m -45.62 -35.78 4.3 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 126.604 1.962 . . . . 0.0 115.849 -169.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -81.26 -61.98 1.79 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.621 1.1 . . . . 0.0 110.494 174.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.23 168.34 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 125.247 2.451 . . . . 0.0 114.512 -169.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -146.56 148.95 35.52 Favored Pre-proline 0 C--N 1.322 -0.613 0 C-N-CA 129.288 3.035 . . . . 0.0 104.551 -173.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -59.97 -33.63 95.51 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 CA-C-N 121.892 1.712 . . . . 0.0 112.516 -174.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -63.61 -50.45 69.32 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 109.074 -0.714 . . . . 0.0 109.074 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 29.9 t -64.51 -38.61 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 C-N-CA 123.674 0.79 . . . . 0.0 109.086 -178.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 70.3 t80 -68.07 -40.93 82.6 Favored 'General case' 0 N--CA 1.444 -0.762 0 O-C-N 121.632 -0.667 . . . . 0.0 111.658 -177.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -81.57 -14.48 56.76 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.989 0.813 . . . . 0.0 111.811 -179.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -67.91 -24.67 65.23 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.671 0.789 . . . . 0.0 109.747 169.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 55.6 mt -63.28 148.53 93.09 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 121.604 -0.685 . . . . 0.0 109.546 173.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -55.62 147.87 57.18 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.726 2.284 . . . . 0.0 110.691 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -47.59 -49.71 26.01 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.879 0.872 . . . . 0.0 111.718 -175.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.54 -27.24 66.8 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -177.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 97.0 t -71.66 -36.74 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 118.826 0.739 . . . . 0.0 109.386 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -65.0 -44.83 87.93 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 122.248 1.023 . . . . 0.0 108.493 -178.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.13 -50.74 70.69 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.184 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -65.18 -38.34 90.2 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 122.955 0.502 . . . . 0.0 111.421 -176.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.85 -42.29 95.01 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 119.986 1.266 . . . . 0.0 110.083 177.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.95 -36.5 84.18 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.329 0.513 . . . . 0.0 110.832 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.26 -37.75 71.93 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.379 0.672 . . . . 0.0 111.123 176.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.91 -50.95 62.62 Favored 'General case' 0 CA--C 1.516 -0.343 0 C-N-CA 125.037 1.335 . . . . 0.0 108.65 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -57.51 -48.25 79.76 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 121.561 -0.712 . . . . 0.0 109.151 174.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.6 tpmp? -69.12 -11.0 60.4 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 117.329 -1.319 . . . . 0.0 113.928 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -105.09 6.06 32.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 121.45 1.932 . . . . 0.0 111.839 173.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 34.8 p -125.66 -17.17 5.55 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.028 0.931 . . . . 0.0 111.861 176.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 N-CA-C 106.856 -2.497 . . . . 0.0 106.856 169.991 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo . . . . . 0 CA--C 1.535 0.552 0 N-CA-C 110.846 -0.482 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 16.9 m 46.78 24.79 0.37 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.066 1.347 . . . . 0.0 112.92 -170.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . 0.374 12.2 t0 32.25 41.0 0.02 OUTLIER 'General case' 0 C--O 1.233 0.234 0 C-N-CA 129.537 3.135 . . . . 0.0 116.114 -169.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 4.5 pt -53.13 148.62 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 122.797 1.284 . . . . 0.0 109.343 169.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -70.84 135.9 85.44 Favored Pre-proline 0 N--CA 1.444 -0.729 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 170.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -55.19 -36.69 93.83 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.854 1.703 . . . . 0.0 111.452 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -64.94 -44.5 89.28 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -176.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 51.4 t -69.06 -42.58 82.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -56.56 -45.11 81.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.157 -0.964 . . . . 0.0 113.444 173.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -84.93 -5.75 59.34 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 118.763 0.71 . . . . 0.0 111.587 -174.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -77.04 -22.38 53.05 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.783 1.233 . . . . 0.0 109.252 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 91.3 mt -58.98 150.55 60.44 Favored Pre-proline 0 CA--C 1.534 0.346 0 O-C-N 121.389 -0.82 . . . . 0.0 109.968 175.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -53.49 147.63 37.42 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 123.253 2.635 . . . . 0.0 110.631 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -48.73 -48.59 40.45 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.602 0.761 . . . . 0.0 111.428 -174.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.85 -25.79 63.9 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -178.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 89.3 t -70.9 -43.77 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 119.288 0.949 . . . . 0.0 108.858 172.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -58.52 -47.26 84.73 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.66 0.664 . . . . 0.0 109.314 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.72 -43.26 97.06 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 117.973 -1.013 . . . . 0.0 109.904 -179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -66.8 -39.14 87.64 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 119.255 0.934 . . . . 0.0 111.038 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -42.87 96.2 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 121.409 -0.807 . . . . 0.0 109.467 176.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 32.2 mt -63.79 -40.97 97.94 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.967 0.803 . . . . 0.0 110.911 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -62.52 -40.92 98.32 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.726 -0.655 . . . . 0.0 110.337 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -60.13 -54.46 45.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 26.9 m0 -66.99 0.23 2.69 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.524 1.13 . . . . 0.0 113.261 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . 0.504 ' HZ2' ' C ' ' A' ' 707' ' ' GLY . 1.2 tppm? -125.55 10.91 7.91 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.786 -1.196 . . . . 0.0 113.63 169.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -117.99 13.91 14.03 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.714 1.206 . . . . 0.0 110.542 169.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 24.7 p -131.92 -7.41 3.52 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.148 1.779 . . . . 0.0 111.518 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . 0.504 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.253 1.289 0 N-CA-C 104.665 -3.374 . . . . 0.0 104.665 -169.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo . . . . . 0 CA--C 1.542 0.894 0 CA-C-O 121.664 0.61 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 14.4 m -148.58 17.73 1.03 Allowed 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.413 -1.429 . . . . 0.0 111.736 176.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -87.71 -38.66 15.63 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.375 1.47 . . . . 0.0 109.219 169.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 12.9 pt -83.9 145.26 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 C-N-CA 124.845 1.258 . . . . 0.0 110.669 170.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -84.3 142.59 40.92 Favored Pre-proline 0 CA--C 1.541 0.632 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 168.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -74.77 -29.0 9.13 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 CA-C-N 120.286 1.138 . . . . 0.0 111.064 -171.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -69.14 -43.76 73.71 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 119.481 1.037 . . . . 0.0 109.09 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 92.2 t -56.58 -44.82 81.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 174.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.403 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 90.7 t80 -59.58 -43.14 93.72 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 175.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -78.13 -13.08 60.0 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.761 1.164 . . . . 0.0 112.367 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -82.09 -7.01 59.6 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.019 0.928 . . . . 0.0 110.933 168.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 71.8 mt -65.61 152.91 91.75 Favored Pre-proline 0 CA--C 1.534 0.354 0 O-C-N 121.036 -1.04 . . . . 0.0 109.083 169.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -55.2 145.99 62.5 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.074 2.516 . . . . 0.0 110.511 178.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 32.3 tp10 -46.21 -50.18 16.16 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.267 1.027 . . . . 0.0 112.09 -174.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.88 -29.47 67.77 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -177.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 94.2 t -68.04 -41.34 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.403 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.3 mt-30 -63.31 -46.68 85.55 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 -177.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -40.9 85.74 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 117.393 -1.289 . . . . 0.0 110.57 -175.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -69.8 -43.69 71.56 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 119.921 1.237 . . . . 0.0 111.146 179.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . 0.456 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 1.5 mm? -61.76 -42.87 99.55 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 121.132 -0.98 . . . . 0.0 111.041 177.345 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 27.5 mt -64.69 -39.52 93.81 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.394 0.543 . . . . 0.0 110.696 176.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -56.38 -55.97 26.94 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-O 115.968 -1.968 . . . . 0.0 108.537 170.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -49.32 -49.16 45.22 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 122.558 2.436 . . . . 0.0 110.122 175.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . 0.456 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 44.4 m0 -70.56 -4.51 23.4 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -175.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 1.7 tppm? -135.67 -5.97 2.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 121.148 1.795 . . . . 0.0 115.029 169.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -77.19 -37.51 53.42 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 127.184 2.194 . . . . 0.0 109.095 170.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.52 61.34 0.72 Allowed 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 -168.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.039 0 N-CA-C 109.364 -1.494 . . . . 0.0 109.364 -169.619 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo . . . . . 0 N--CA 1.46 -0.468 0 CA-C-O 118.407 -0.747 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 19.3 m 116.93 16.57 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 131.528 3.931 . . . . 0.0 110.39 -178.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -114.97 -37.94 4.03 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.761 1.624 . . . . 0.0 112.808 -169.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.3 pt -92.1 138.65 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.723 1.209 . . . . 0.0 111.617 -173.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -65.69 138.75 96.77 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 168.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.61 -28.12 10.2 Favored 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 121.278 1.319 . . . . 0.0 111.165 -169.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 23.6 mm100 -69.1 -46.77 66.91 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 119.484 1.038 . . . . 0.0 108.436 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 89.3 t -57.99 -36.03 54.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.339 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 688' ' ' PHE . . . . . 0.409 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 73.0 t80 -68.89 -53.04 23.4 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 119.363 0.983 . . . . 0.0 113.608 169.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -75.87 -10.64 59.6 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.968 -1.082 . . . . 0.0 112.954 -169.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -83.91 -1.87 55.37 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.808 1.243 . . . . 0.0 111.196 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 58.7 mt -70.59 156.65 91.63 Favored Pre-proline 0 CA--C 1.535 0.397 0 O-C-N 120.859 -1.151 . . . . 0.0 109.415 169.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -56.33 142.77 87.92 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.251 2.634 . . . . 0.0 110.696 177.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.02 -36.06 67.54 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.688 0.795 . . . . 0.0 112.948 -172.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.96 -33.27 70.29 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.297 -0.877 . . . . 0.0 113.093 175.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 75.5 t -65.11 -43.34 95.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 173.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.409 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.4 mt-30 -56.48 -53.12 61.21 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -53.45 -41.36 66.06 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 118.089 -0.958 . . . . 0.0 113.03 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -42.31 84.37 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.75 0.705 . . . . 0.0 110.193 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -66.08 -36.21 82.59 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 120.999 -1.063 . . . . 0.0 112.569 174.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.56 -44.51 96.08 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.711 1.141 . . . . 0.0 108.753 172.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.99 96.55 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.511 177.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.13 -46.17 90.54 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 119.937 1.244 . . . . 0.0 110.437 177.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 38.9 m0 -64.72 -14.1 57.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 120.653 -1.28 . . . . 0.0 112.099 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 704' ' ' LYS . . . . . 0.489 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.5 OUTLIER -103.64 -17.33 15.19 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 117.749 -1.119 . . . . 0.0 112.51 168.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 80.7 mtm-85 -69.72 -40.68 76.09 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 121.41 1.914 . . . . 0.0 109.244 169.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 20.7 p -77.21 29.79 0.14 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.075 1.75 . . . . 0.0 113.244 -169.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.642 0 N-CA-C 108.763 -1.735 . . . . 0.0 108.763 -170.6 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.527 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 68.8 m80 -147.55 146.42 29.43 Favored 'General case' 0 C--N 1.339 0.112 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 12.7 ptm 46.09 17.91 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.708 2.003 . . . . 0.0 114.709 -169.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -152.35 152.56 29.45 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 128.337 2.655 . . . . 0.0 105.641 -174.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.264 0.0 OUTLIER -11.46 -88.07 0.0 OUTLIER 'Trans proline' 0 C--N 1.351 0.706 1 C-N-CA 127.347 5.364 . . . . 0.0 118.91 -176.584 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 67.6 m -160.17 -40.27 0.05 Allowed 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 119.751 1.159 . . . . 0.0 110.815 177.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -77.55 -63.09 1.46 Allowed 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 125.318 1.447 . . . . 0.0 109.343 176.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 1.4 pt -61.71 116.91 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 C-N-CA 125.49 1.516 . . . . 0.0 110.728 -172.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -83.53 157.83 63.97 Favored Pre-proline 0 C--N 1.324 -0.504 0 N-CA-C 105.99 -1.856 . . . . 0.0 105.99 168.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_exo -56.72 -42.56 63.69 Favored 'Trans proline' 0 N--CA 1.455 -0.775 0 C-N-CA 122.573 2.182 . . . . 0.0 111.093 -169.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -63.86 -43.53 95.81 Favored 'General case' 0 N--CA 1.446 -0.631 0 O-C-N 123.728 0.642 . . . . 0.0 110.003 -176.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 15.6 t -65.94 -36.89 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.752 0.821 . . . . 0.0 109.785 -178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -64.37 -37.9 89.13 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.429 -0.794 . . . . 0.0 111.19 174.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -81.47 -14.38 57.08 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 118.933 0.788 . . . . 0.0 112.658 -178.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 74.1 mt-10 -73.63 -16.16 61.24 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.991 1.317 . . . . 0.0 110.723 169.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 81.1 mt -66.97 150.82 97.67 Favored Pre-proline 0 CA--C 1.533 0.306 0 O-C-N 121.521 -0.737 . . . . 0.0 109.186 171.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -54.97 142.46 76.16 Favored 'Trans proline' 0 N--CA 1.455 -0.777 0 C-N-CA 122.372 2.048 . . . . 0.0 110.33 173.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.89 -35.68 61.87 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.984 0.914 . . . . 0.0 112.178 -178.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -72.47 -28.66 63.05 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 176.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 61.2 t -70.68 -37.46 69.38 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 172.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -62.26 -50.37 72.01 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -176.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -49.18 -48.24 45.31 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.79 1.236 . . . . 0.0 113.363 172.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.46 -41.74 96.33 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 118.527 0.603 . . . . 0.0 110.412 -179.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.98 -32.52 73.88 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 121.151 -0.968 . . . . 0.0 111.948 175.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 62.8 mt -63.34 -40.35 97.05 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 119.734 1.152 . . . . 0.0 109.885 171.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.12 -34.32 70.95 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.257 176.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.39 -51.71 61.84 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 124.377 1.071 . . . . 0.0 109.598 176.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 21.2 m0 -59.94 -46.31 89.81 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 175.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.6 tptp -69.16 -11.35 60.72 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 120.357 1.435 . . . . 0.0 113.771 178.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 10.5 ptt180 -104.14 5.0 34.73 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 121.417 1.917 . . . . 0.0 111.821 172.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 29.5 p -124.42 -14.96 6.79 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.56 0.744 . . . . 0.0 112.202 174.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.03 0 N-CA-C 106.9 -2.48 . . . . 0.0 106.9 170.352 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.251 0 N-CA-C 109.913 -1.275 . . . . 0.0 109.913 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -66.76 143.41 56.94 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 118.473 1.136 . . . . 0.0 110.336 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 12.6 ttp 54.88 8.46 0.23 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.067 2.147 . . . . 0.0 116.492 169.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -149.08 173.48 4.19 Favored Pre-proline 0 C--N 1.327 -0.391 0 C-N-CA 125.659 1.584 . . . . 0.0 107.171 -170.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_exo -43.5 157.86 0.11 Allowed 'Trans proline' 0 CA--C 1.537 0.653 0 C-N-CA 122.491 2.127 . . . . 0.0 113.613 168.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 2.3 m -48.82 -37.84 20.47 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.446 1.498 . . . . 0.0 114.331 -169.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 17.1 p-10 -79.75 -70.34 0.52 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.503 1.521 . . . . 0.0 110.887 -179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 1.5 pt -62.04 117.25 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 C-N-CA 125.739 1.615 . . . . 0.0 110.846 -170.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.14 160.43 62.9 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 107.293 -1.373 . . . . 0.0 107.293 169.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -58.96 -38.29 88.88 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.419 2.079 . . . . 0.0 111.563 -174.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 12.9 mm100 -56.92 -54.62 44.49 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 124.011 0.819 . . . . 0.0 110.019 175.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 11.2 t -65.33 -33.59 64.7 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.173 0 C-N-CA 123.015 0.526 . . . . 0.0 109.618 -174.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.427 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 75.7 t80 -68.44 -39.42 81.53 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.985 -0.447 . . . . 0.0 112.139 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -84.34 -16.94 41.12 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.904 0.774 . . . . 0.0 111.653 -178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -71.81 -13.93 61.83 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.687 1.195 . . . . 0.0 110.41 169.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 87.9 mt -67.02 151.97 96.55 Favored Pre-proline 0 CA--C 1.536 0.408 0 O-C-N 121.436 -0.79 . . . . 0.0 109.349 169.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -55.03 144.12 70.24 Favored 'Trans proline' 0 N--CA 1.453 -0.862 0 C-N-CA 122.421 2.08 . . . . 0.0 110.091 175.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -30.87 -63.84 0.14 Allowed 'General case' 0 C--O 1.232 0.146 0 C-N-CA 126.922 2.089 . . . . 0.0 111.328 175.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.58 -23.94 64.55 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -172.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 80.6 t -69.48 -36.25 70.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 CA-C-N 119.17 0.895 . . . . 0.0 109.374 173.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.427 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 59.6 mt-30 -65.93 -46.32 78.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 -177.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -67.83 -41.92 82.27 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 114.381 -1.281 . . . . 0.0 109.325 -175.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -65.63 -41.36 92.75 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 119.094 -0.479 . . . . 0.0 110.884 176.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.96 -36.29 83.9 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 119.563 1.074 . . . . 0.0 110.696 177.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 44.6 mt -67.42 -41.54 84.68 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.835 0.743 . . . . 0.0 110.204 174.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.46 -37.13 86.09 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 118.281 0.491 . . . . 0.0 110.672 173.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -63.88 -55.19 24.59 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.654 1.182 . . . . 0.0 108.315 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 19.5 m0 -65.85 -7.84 18.59 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 121.329 -0.857 . . . . 0.0 112.877 175.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . 0.498 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -107.74 2.5 23.74 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-O 117.93 -1.033 . . . . 0.0 113.324 169.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -119.34 -2.72 10.57 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.667 1.187 . . . . 0.0 112.364 169.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.9 p -115.84 -7.35 12.05 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.48 1.512 . . . . 0.0 110.962 173.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.882 0 C-N-CA 130.217 3.77 . . . . 0.0 104.072 169.567 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.581 0 N-CA-C 109.671 -1.371 . . . . 0.0 109.671 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -149.04 117.53 6.53 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 178.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 26.6 ptt? 41.47 42.57 1.95 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.495 1.918 . . . . 0.0 115.616 169.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . 0.4 ' CD2' ' HD2' ' A' ' 680' ' ' PRO . 2.9 t80 -139.35 160.42 62.01 Favored Pre-proline 0 CA--C 1.536 0.442 0 O-C-N 121.439 -0.788 . . . . 0.0 109.156 -176.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.4 ' HD2' ' CD2' ' A' ' 679' ' ' PHE . 77.4 Cg_exo -40.65 149.7 0.15 Allowed 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 124.502 3.468 . . . . 0.0 113.091 168.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 11.2 m 46.99 26.39 0.59 Allowed 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.481 1.512 . . . . 0.0 114.779 169.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . 0.267 23.5 t0 51.99 32.63 10.41 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.719 2.008 . . . . 0.0 114.471 -174.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . 0.401 HG21 HD13 ' A' ' 683' ' ' ILE . 22.9 mt -70.52 173.61 0.78 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 104.568 -2.382 . . . . 0.0 104.568 168.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -112.41 147.47 37.1 Favored Pre-proline 0 C--N 1.321 -0.646 0 N-CA-C 105.836 -1.912 . . . . 0.0 105.836 169.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_exo -65.33 -34.91 42.61 Favored 'Trans proline' 0 N--CA 1.448 -1.205 0 CA-C-N 120.775 1.313 . . . . 0.0 111.549 -169.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -65.61 -48.65 71.54 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 176.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 49.4 t -55.05 -33.71 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 123.5 0.72 . . . . 0.0 110.224 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.417 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 65.6 t80 -75.52 -47.99 24.5 Favored 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 178.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -78.56 -11.95 59.99 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.032 -1.043 . . . . 0.0 111.728 -175.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -70.53 -20.47 62.81 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.085 1.354 . . . . 0.0 109.751 168.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 73.3 mt -65.6 151.52 94.41 Favored Pre-proline 0 CA--C 1.533 0.297 0 O-C-N 121.393 -0.817 . . . . 0.0 109.47 178.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_exo -54.39 146.88 49.37 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 123.222 2.615 . . . . 0.0 110.031 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.3 tp10 -47.63 -49.5 26.98 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 123.553 0.741 . . . . 0.0 112.021 -173.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -66.78 -30.45 70.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 93.3 t -68.14 -39.3 81.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 175.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.417 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 73.6 mt-30 -64.07 -45.13 90.14 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 122.315 1.055 . . . . 0.0 108.214 -178.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.08 -52.42 65.42 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.42 -1.263 . . . . 0.0 109.917 -178.804 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -64.64 -36.74 85.23 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-N 118.941 0.791 . . . . 0.0 111.599 -178.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.04 -38.61 86.18 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.018 0.826 . . . . 0.0 110.33 177.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 31.0 mt -68.49 -38.07 80.66 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 119.546 1.066 . . . . 0.0 110.42 174.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.49 -38.84 92.69 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 118.685 0.675 . . . . 0.0 110.242 173.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.27 -55.33 33.18 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 124.164 0.985 . . . . 0.0 108.775 177.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 22.8 m0 -67.16 -6.22 16.88 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.088 -1.007 . . . . 0.0 112.841 177.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . 0.501 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -110.3 3.01 19.5 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 119.402 1.001 . . . . 0.0 112.903 170.321 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -117.96 -9.55 10.57 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.528 1.131 . . . . 0.0 112.319 169.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.5 p -108.87 -5.68 16.09 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.465 1.506 . . . . 0.0 111.518 173.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.271 0 N-CA-C 104.32 -3.512 . . . . 0.0 104.32 169.461 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.523 0 N-CA-C 107.263 -2.335 . . . . 0.0 107.263 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . 0.446 ' CG ' ' H ' ' A' ' -1' ' ' MET . 43.6 t60 62.39 169.17 0.13 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.65 1.58 . . . . 0.0 110.182 -168.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . 0.446 ' H ' ' CG ' ' A' ' -2' ' ' HIS . 7.3 tpt -49.67 -30.65 9.47 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 126.851 2.06 . . . . 0.0 115.392 -169.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -155.68 127.78 3.94 Favored Pre-proline 0 CA--C 1.538 0.492 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 169.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -66.29 -152.96 0.02 OUTLIER 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 125.285 3.99 . . . . 0.0 112.243 168.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 12.9 m -145.64 9.0 1.17 Allowed 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.191 -1.568 . . . . 0.0 112.942 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -77.37 -0.65 26.5 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.704 1.602 . . . . 0.0 111.933 169.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 8.8 pt -145.05 163.14 13.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 C-N-CA 127.436 2.294 . . . . 0.0 108.479 -172.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -102.75 150.42 37.71 Favored Pre-proline 0 CA--C 1.542 0.653 0 C-N-CA 125.331 1.452 . . . . 0.0 107.207 170.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo -66.53 -37.48 22.38 Favored 'Trans proline' 0 N--CA 1.452 -0.957 0 C-N-CA 123.0 2.466 . . . . 0.0 113.413 -173.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 19.5 mm100 -68.25 -46.66 69.87 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 86.1 t -56.37 -40.51 67.26 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -64.26 -52.71 57.34 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 113.563 0.949 . . . . 0.0 113.563 173.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -69.33 -26.13 64.55 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 119.572 1.078 . . . . 0.0 111.569 -171.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -71.13 -7.82 49.24 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.818 1.647 . . . . 0.0 112.461 171.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 51.6 mt -65.07 153.83 88.16 Favored Pre-proline 0 CA--C 1.537 0.47 0 O-C-N 120.746 -1.221 . . . . 0.0 109.62 169.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -53.63 142.45 60.73 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 123.405 2.737 . . . . 0.0 109.851 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 21.9 tp10 -48.75 -41.51 32.41 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 123.683 0.793 . . . . 0.0 112.786 -172.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -73.65 -31.69 63.62 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 72.8 t -66.2 -48.17 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 170.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -55.03 -43.56 73.83 Favored 'General case' 0 N--CA 1.433 -1.309 0 C-N-CA 123.854 0.862 . . . . 0.0 110.919 179.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.41 -45.41 91.11 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 117.537 -1.22 . . . . 0.0 110.459 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 35.8 tp10 -71.02 -39.92 72.06 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.742 1.156 . . . . 0.0 111.342 -177.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . 0.505 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 0.8 OUTLIER -64.36 -44.97 89.76 Favored 'General case' 0 C--O 1.226 -0.163 0 O-C-N 121.47 -0.769 . . . . 0.0 110.974 175.332 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 61.3 mt -58.15 -39.86 79.88 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 119.147 0.885 . . . . 0.0 109.821 173.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -64.92 -44.67 88.77 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 117.412 -1.28 . . . . 0.0 111.089 178.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -52.98 -50.48 64.04 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 120.639 1.563 . . . . 0.0 108.825 172.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . 0.505 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 49.6 m0 -68.23 -9.04 44.29 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.026 1.33 . . . . 0.0 113.532 -177.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 1.3 tppm? -110.31 -3.36 16.25 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.734 0.814 . . . . 0.0 112.182 169.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -91.32 -6.61 52.81 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 119.208 0.913 . . . . 0.0 109.509 168.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 54.4 p -131.08 4.63 4.44 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 114.131 1.159 . . . . 0.0 114.131 -169.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 N-CA-C 106.312 -2.715 . . . . 0.0 106.312 -176.052 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.645 0 CA-C-O 119.687 -0.507 . . . . 0.0 113.236 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 55.6 m80 -125.45 -21.92 4.42 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.354 1.462 . . . . 0.0 110.201 169.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 28.4 ttt -135.64 3.16 2.99 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.787 1.635 . . . . 0.0 110.903 175.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -140.9 175.66 2.95 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 127.184 2.193 . . . . 0.0 106.632 174.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_exo -39.84 156.2 0.04 OUTLIER 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 123.476 2.784 . . . . 0.0 114.906 169.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.7 m -40.6 -39.33 1.03 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.651 1.98 . . . . 0.0 116.32 -169.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 16.4 p-10 -82.27 -69.05 0.65 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.972 1.309 . . . . 0.0 110.517 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.5 pt -62.38 160.46 2.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 C-N-CA 125.807 1.643 . . . . 0.0 112.577 -172.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -142.57 166.48 20.66 Favored Pre-proline 0 N--CA 1.464 0.257 0 N-CA-C 106.776 -1.565 . . . . 0.0 106.776 169.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -54.81 -37.99 92.24 Favored 'Trans proline' 0 CA--C 1.505 -0.973 0 C-N-CA 122.553 2.169 . . . . 0.0 113.725 -168.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -61.6 -54.84 37.58 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 13.9 t -65.89 -34.18 68.59 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.24 0 C-N-CA 124.471 1.108 . . . . 0.0 109.811 -173.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 66.6 t80 -72.31 -37.4 68.95 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 122.906 0.482 . . . . 0.0 111.848 179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -83.07 -16.86 45.28 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 118.547 0.612 . . . . 0.0 111.301 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -71.56 -12.55 61.42 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.544 1.138 . . . . 0.0 110.872 169.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 69.7 mt -73.61 152.44 89.5 Favored Pre-proline 0 CA--C 1.539 0.538 0 O-C-N 121.313 -0.867 . . . . 0.0 109.766 174.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -56.47 155.64 24.92 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 123.194 2.596 . . . . 0.0 111.528 172.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.87 -42.07 46.9 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.527 0.731 . . . . 0.0 110.81 176.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -62.11 -53.46 55.16 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.322 -0.621 . . . . 0.0 109.322 -176.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 41.3 t -60.15 -32.47 50.58 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.476 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.9 mt-30 -68.84 -55.9 9.69 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 120.071 1.305 . . . . 0.0 108.606 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . 0.414 ' HE3' ' HB3' ' A' ' 697' ' ' LYS 0.335 0.0 OUTLIER -74.24 -30.79 62.32 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.374 -0.822 . . . . 0.0 112.248 -169.404 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -68.23 -39.97 82.15 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 119.671 1.123 . . . . 0.0 109.101 170.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.25 -36.94 85.72 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.561 1.073 . . . . 0.0 110.116 174.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 15.1 mt -62.47 -42.26 99.36 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-N 119.114 0.87 . . . . 0.0 110.143 175.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -68.0 -42.17 81.15 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.869 0.759 . . . . 0.0 110.827 178.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -59.26 -53.19 61.04 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.142 1.377 . . . . 0.0 109.454 -179.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.2 m0 -66.88 -32.15 73.22 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 118.408 -0.806 . . . . 0.0 110.923 177.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . 0.42 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -60.72 -25.94 66.81 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 119.566 1.075 . . . . 0.0 111.829 174.254 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 29.9 mtm105 -64.44 -12.39 43.01 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.963 1.256 . . . . 0.0 113.543 170.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 1.9 p -130.17 -17.36 3.45 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 114.128 1.159 . . . . 0.0 114.128 -169.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.934 0 N-CA-C 105.903 -2.879 . . . . 0.0 105.903 176.375 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 683' ' ' ILE . . . . . . . . 0 N--CA 1.47 0.942 0 N-CA-C 114.828 0.691 . . . . 0.0 114.828 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -35.99 75.9 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 118.31 1.055 . . . . 0.0 111.742 169.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 8.5 ptm -148.56 35.08 0.78 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.311 1.044 . . . . 0.0 110.171 178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . 0.414 ' CZ ' ' CD2' ' A' ' 688' ' ' PHE . 5.7 m-85 -150.3 171.76 6.03 Favored Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 127.069 2.148 . . . . 0.0 106.402 -173.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_exo -40.34 145.59 0.33 Allowed 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 122.615 2.21 . . . . 0.0 112.288 168.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 2.2 m -45.96 -39.34 8.8 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 114.781 1.401 . . . . 0.0 114.781 -168.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 11.7 p-10 -66.15 -85.11 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.885 2.074 . . . . 0.0 111.021 173.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . 0.419 ' O ' ' HA2' ' A' ' -3' ' ' GLY . 4.0 pt -55.16 118.21 1.32 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.189 0 C-N-CA 125.533 1.533 . . . . 0.0 110.107 -169.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.6 152.78 67.34 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 170.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_exo -57.38 -37.17 98.32 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 123.163 2.575 . . . . 0.0 111.771 -169.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . 0.428 ' CD ' ' H ' ' A' ' 686' ' ' GLN . 2.5 mp0 -56.41 -55.37 34.37 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 5.2 t -60.82 -37.28 76.01 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.122 0 C-N-CA 124.532 1.133 . . . . 0.0 109.607 -176.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 72.0 t80 -69.61 -40.76 76.43 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 119.068 -0.491 . . . . 0.0 112.029 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -77.0 -20.29 56.23 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 119.456 1.026 . . . . 0.0 111.281 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -70.52 -11.22 60.79 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.282 1.033 . . . . 0.0 111.524 169.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 83.1 mt -70.59 152.32 95.34 Favored Pre-proline 0 CA--C 1.535 0.379 0 O-C-N 121.057 -1.027 . . . . 0.0 109.139 169.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -53.98 147.34 43.25 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 122.464 2.109 . . . . 0.0 110.162 175.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 41.0 tp10 -40.95 -57.51 1.97 Allowed 'General case' 0 C--O 1.231 0.125 0 C-N-CA 125.069 1.348 . . . . 0.0 111.05 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.01 -25.04 63.4 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -173.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 78.9 t -67.31 -45.14 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.459 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 62.9 mt-30 -55.53 -43.24 75.59 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 121.249 0.547 . . . . 0.0 109.645 178.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 11.7 mptt -74.21 -40.75 62.25 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 117.947 -1.025 . . . . 0.0 110.218 -173.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -62.99 -40.08 96.7 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-N 119.219 0.918 . . . . 0.0 110.862 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.3 -38.61 91.65 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 119.468 1.031 . . . . 0.0 111.272 177.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.19 -44.38 84.15 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 118.923 0.783 . . . . 0.0 110.116 174.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.13 82.9 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-O 119.148 -0.453 . . . . 0.0 110.58 174.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -62.75 -54.83 33.2 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.463 1.105 . . . . 0.0 108.113 178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 22.1 m0 -65.73 -2.84 4.0 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.285 1.034 . . . . 0.0 113.045 176.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -117.13 5.06 12.71 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.861 1.209 . . . . 0.0 113.759 169.067 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 19.1 ptt180 -117.93 9.46 12.84 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.638 1.175 . . . . 0.0 111.461 169.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 28.8 p -125.9 -3.56 7.06 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.206 1.402 . . . . 0.0 111.884 -179.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.257 1.577 0 N-CA-C 105.388 -3.085 . . . . 0.0 105.388 -172.645 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.493 0 N-CA-C 107.264 -2.334 . . . . 0.0 107.264 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -67.93 -21.88 65.09 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.019 0.91 . . . . 0.0 110.817 169.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 24.3 ttt -152.69 159.24 43.17 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 127.108 2.163 . . . . 0.0 105.359 173.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 46.3 m-85 64.39 164.43 0.12 Allowed Pre-proline 0 CA--C 1.552 1.047 0 CA-C-N 120.271 1.396 . . . . 0.0 110.385 -168.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -43.59 156.61 0.15 Allowed 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.731 2.954 . . . . 0.0 114.826 169.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 4.2 m -60.67 -30.3 69.83 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.418 1.087 . . . . 0.0 113.539 -172.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -69.06 -9.94 55.07 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.848 2.459 . . . . 0.0 114.111 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 13.1 pt -145.82 -178.24 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 125.549 1.54 . . . . 0.0 108.323 -174.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -152.03 162.75 25.73 Favored Pre-proline 0 C--O 1.235 0.34 0 N-CA-C 104.812 -2.292 . . . . 0.0 104.812 168.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -57.51 -36.71 98.65 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.213 1.942 . . . . 0.0 113.577 -168.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -62.37 -53.46 54.71 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.933 -1.136 . . . . 0.0 107.933 -177.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 4.1 t -68.73 -33.19 58.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.748 -173.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.47 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 66.6 t80 -65.73 -39.39 91.09 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 118.391 0.541 . . . . 0.0 111.161 177.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -81.4 -16.6 51.67 Favored 'General case' 0 CA--C 1.534 0.354 0 O-C-N 121.68 -0.638 . . . . 0.0 111.551 178.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -75.18 -13.22 60.44 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.168 0.894 . . . . 0.0 110.832 169.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 64.6 mt -68.84 152.32 96.82 Favored Pre-proline 0 C--N 1.344 0.357 0 O-C-N 121.075 -1.016 . . . . 0.0 109.216 170.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -53.65 144.74 51.74 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.382 2.055 . . . . 0.0 110.745 173.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -56.05 -34.35 65.82 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.598 0.759 . . . . 0.0 112.791 -176.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.5 -38.78 74.38 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.701 -0.624 . . . . 0.0 112.49 173.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 96.2 t -61.53 -37.11 77.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 O-C-N 120.88 -1.137 . . . . 0.0 109.559 175.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.47 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 68.5 mt-30 -58.52 -53.93 52.78 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 176.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 68.2 mttt -51.75 -52.44 48.65 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 178.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.19 -36.14 79.11 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -171.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.03 -38.67 89.59 Favored 'General case' 0 N--CA 1.456 -0.126 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.495 171.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 12.0 mt -61.75 -38.35 87.66 Favored 'General case' 0 C--N 1.344 0.335 0 CA-C-N 119.425 1.012 . . . . 0.0 110.343 173.522 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.02 -44.47 72.67 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 118.561 0.619 . . . . 0.0 110.901 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 32.9 mm-40 -60.44 -52.28 65.9 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 176.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.4 m0 -58.61 -46.1 87.75 Favored 'General case' 0 C--O 1.223 -0.321 0 CA-C-O 118.531 -0.747 . . . . 0.0 110.06 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.7 tptp -68.13 -19.56 64.83 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 120.405 1.457 . . . . 0.0 112.643 -178.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -84.87 -4.68 59.2 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 120.692 1.587 . . . . 0.0 113.083 169.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 37.5 p -126.3 -15.26 5.74 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 120.165 1.348 . . . . 0.0 112.325 -171.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.975 0 N-CA-C 106.282 -2.727 . . . . 0.0 106.282 169.869 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.226 0 N-CA-C 108.342 -1.903 . . . . 0.0 108.342 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 17.3 p80 -87.84 -15.4 36.92 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.44 1.096 . . . . 0.0 112.999 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 28.4 ttt -149.29 -33.77 0.2 Allowed 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 120.195 1.361 . . . . 0.0 113.787 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -100.38 175.75 2.24 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-O 118.496 -0.764 . . . . 0.0 108.953 170.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_exo -42.77 161.31 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.719 2.946 . . . . 0.0 114.869 169.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 5.0 m -55.55 -27.37 48.59 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 115.173 1.545 . . . . 0.0 115.173 -169.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -91.03 -7.78 50.91 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.615 1.966 . . . . 0.0 113.512 -172.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.3 pt -140.05 170.27 15.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 125.72 1.608 . . . . 0.0 108.569 -174.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -151.82 170.04 8.53 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 168.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -54.58 -37.12 90.64 Favored 'Trans proline' 0 N--CA 1.451 -0.973 0 C-N-CA 122.056 1.837 . . . . 0.0 113.062 -168.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -61.6 -55.73 27.58 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 179.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.47 -36.51 76.54 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 C-N-CA 124.833 1.253 . . . . 0.0 109.93 -172.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.416 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 52.6 t80 -73.49 -37.58 65.68 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.836 -0.54 . . . . 0.0 111.315 -178.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -81.36 -16.17 53.09 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.805 -0.559 . . . . 0.0 110.936 179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -73.3 -13.43 61.12 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.343 1.057 . . . . 0.0 110.762 169.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 69.2 mt -73.72 152.86 89.34 Favored Pre-proline 0 CA--C 1.534 0.332 0 O-C-N 121.142 -0.974 . . . . 0.0 109.108 172.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -54.69 142.54 72.75 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.076 1.851 . . . . 0.0 110.611 172.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -55.63 -33.91 64.45 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.583 0.753 . . . . 0.0 112.098 -179.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -72.45 -30.51 64.64 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.341 -0.849 . . . . 0.0 113.205 175.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 64.4 t -69.0 -42.44 82.11 Favored 'Isoleucine or valine' 0 C--O 1.23 0.051 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 172.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.416 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 73.8 mt-30 -54.82 -49.87 69.97 Favored 'General case' 0 C--N 1.341 0.197 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -54.39 -46.98 73.19 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 175.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.62 -40.25 95.15 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.625 0.648 . . . . 0.0 110.499 -177.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . 0.408 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 0.2 OUTLIER -62.86 -32.65 73.93 Favored 'General case' 0 C--N 1.332 -0.152 0 C-N-CA 124.224 1.01 . . . . 0.0 111.375 175.689 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 18.8 mt -65.7 -41.54 92.24 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 120.066 1.303 . . . . 0.0 110.261 170.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.78 -38.35 90.76 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.45 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -59.58 -55.3 36.25 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 119.103 0.865 . . . . 0.0 109.43 173.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . 0.408 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 20.1 m0 -71.62 4.87 2.77 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.214 -0.929 . . . . 0.0 112.638 177.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . 0.473 ' HZ2' ' C ' ' A' ' 707' ' ' GLY 0.266 1.2 tppm? -124.4 10.79 8.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.588 1.155 . . . . 0.0 112.617 169.064 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -122.51 4.99 9.59 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.815 1.246 . . . . 0.0 110.98 168.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 32.5 p -121.6 -6.91 9.17 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.453 1.501 . . . . 0.0 111.656 178.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . 0.473 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.245 0.831 0 N-CA-C 105.531 -3.028 . . . . 0.0 105.531 -176.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.331 0 N-CA-C 107.915 -2.074 . . . . 0.0 107.915 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . 0.606 ' CG ' ' H ' ' A' ' -1' ' ' MET . 25.4 t-80 62.97 -172.32 0.16 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.914 1.286 . . . . 0.0 110.685 -171.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . 0.606 ' H ' ' CG ' ' A' ' -2' ' ' HIS . 13.3 tpt -105.03 -23.48 12.94 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.353 1.061 . . . . 0.0 111.706 -172.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -152.78 154.1 30.94 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 123.992 0.917 . . . . 0.0 109.985 172.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_exo -68.53 -157.8 0.04 OUTLIER 'Trans proline' 0 CA--C 1.546 1.101 1 C-N-CA 125.885 4.39 . . . . 0.0 111.636 168.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 70.3 p -135.38 49.24 2.19 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.589 1.156 . . . . 0.0 109.248 -176.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.4 -58.39 0.13 Allowed 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.396 1.078 . . . . 0.0 109.383 -169.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 12.8 pt -69.93 128.97 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 123.565 0.746 . . . . 0.0 109.025 169.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -73.83 139.62 77.13 Favored Pre-proline 0 CA--C 1.54 0.591 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 168.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.83 -37.09 97.66 Favored 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 122.698 2.266 . . . . 0.0 112.017 -174.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -68.88 -41.19 78.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 119.069 -0.491 . . . . 0.0 109.68 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 99.7 t -62.41 -40.74 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.271 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 177.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.466 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 84.5 t80 -62.45 -40.17 95.76 Favored 'General case' 0 N--CA 1.45 -0.47 0 O-C-N 121.344 -0.847 . . . . 0.0 112.376 173.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -76.91 -10.86 59.65 Favored 'General case' 0 CA--C 1.539 0.533 0 O-C-N 121.488 -0.758 . . . . 0.0 111.998 -178.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -72.98 -21.27 60.87 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.502 1.047 . . . . 0.0 110.3 168.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 83.7 mt -61.25 151.16 77.24 Favored Pre-proline 0 CA--C 1.536 0.409 0 O-C-N 121.092 -1.005 . . . . 0.0 109.658 175.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -54.06 148.05 41.09 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 123.12 2.547 . . . . 0.0 110.981 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 48.3 tp10 -34.06 -62.89 0.3 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 126.367 1.867 . . . . 0.0 111.331 176.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.48 -27.45 64.22 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 113.713 1.005 . . . . 0.0 113.713 -172.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 72.7 t -64.97 -45.62 94.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 174.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.466 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 60.1 mt-30 -56.84 -49.59 74.98 Favored 'General case' 0 N--CA 1.449 -0.51 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -67.21 -33.04 74.52 Favored 'General case' 0 CA--C 1.523 -0.089 0 CA-C-O 116.93 -1.51 . . . . 0.0 111.893 -169.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -67.1 -50.5 61.38 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.244 1.384 . . . . 0.0 109.706 172.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -59.0 -38.74 79.9 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 119.396 0.998 . . . . 0.0 111.652 179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 45.5 mt -67.99 -43.49 78.79 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.719 0.808 . . . . 0.0 109.994 176.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.25 -28.47 66.34 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-O 118.635 -0.698 . . . . 0.0 111.515 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -66.87 -61.35 2.0 Allowed 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 170.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.3 m0 -57.89 -20.55 37.66 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 117.339 -1.315 . . . . 0.0 112.071 -178.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 4.2 mmpm? -89.28 -34.22 16.67 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 122.252 2.296 . . . . 0.0 112.794 169.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 7.5 ptp85 -65.64 -19.86 66.08 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 120.871 1.669 . . . . 0.0 110.744 177.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 24.3 p -106.38 21.33 17.58 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.788 1.235 . . . . 0.0 111.982 175.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 CA-C-O 118.358 -1.246 . . . . 0.0 110.258 175.023 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.564 0 CA-C-O 118.46 -1.189 . . . . 0.0 110.679 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -139.32 -15.91 1.08 Allowed 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.201 1.501 . . . . 0.0 114.521 -169.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 74.8 mtp -125.34 9.84 7.93 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.622 1.555 . . . . 0.0 112.431 -169.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -149.74 164.22 21.69 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 128.636 2.774 . . . . 0.0 104.409 169.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.271 0.0 OUTLIER -13.07 -75.38 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.805 1 C-N-CA 126.567 4.845 . . . . 0.0 119.669 -169.872 . . . . . . . . 4 3 . 1 . 010 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 59.1 m -160.91 -41.67 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 120.071 1.305 . . . . 0.0 110.463 172.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 19.2 p-10 -81.15 -61.54 1.92 Allowed 'General case' 0 C--O 1.234 0.256 0 C-N-CA 125.946 1.698 . . . . 0.0 109.217 177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 3.4 pt -62.33 156.66 4.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 125.249 1.419 . . . . 0.0 111.605 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -137.94 165.85 30.56 Favored Pre-proline 0 C--N 1.329 -0.298 0 C-N-CA 126.803 2.041 . . . . 0.0 105.898 172.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -58.33 -36.32 97.76 Favored 'Trans proline' 0 CA--C 1.508 -0.775 0 C-N-CA 123.089 2.526 . . . . 0.0 113.795 -168.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -62.36 -54.7 36.55 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.635 -1.246 . . . . 0.0 107.635 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 17.8 t -60.08 -39.47 80.5 Favored 'Isoleucine or valine' 0 N--CA 1.458 -0.073 0 C-N-CA 124.981 1.312 . . . . 0.0 109.25 -174.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.419 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 68.7 t80 -70.52 -39.32 74.14 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 118.764 -0.636 . . . . 0.0 111.808 -177.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -82.84 -16.23 48.49 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.032 0.833 . . . . 0.0 111.234 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -71.24 -11.66 61.04 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.529 1.131 . . . . 0.0 110.656 168.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 53.6 mt -76.5 152.4 83.41 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 124.027 0.931 . . . . 0.0 109.284 171.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -56.2 146.99 68.44 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.944 2.429 . . . . 0.0 110.947 178.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -46.76 -49.91 18.99 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 124.075 0.95 . . . . 0.0 112.003 -176.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.55 -28.28 67.66 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -177.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 81.8 t -69.48 -36.93 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 CA-C-N 118.747 0.703 . . . . 0.0 109.493 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.419 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 70.7 mt-30 -65.38 -46.45 80.05 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.231 1.015 . . . . 0.0 108.365 -178.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.69 -50.26 74.54 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.334 -1.303 . . . . 0.0 109.607 178.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -65.82 -39.52 90.94 Favored 'General case' 0 C--O 1.22 -0.459 0 C-N-CA 123.32 0.648 . . . . 0.0 111.515 -175.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.9 -40.81 95.67 Favored 'General case' 0 N--CA 1.464 0.257 0 O-C-N 121.283 -0.885 . . . . 0.0 109.81 177.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 40.3 mt -65.36 -41.14 94.12 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.085 0.857 . . . . 0.0 110.409 174.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.74 -40.7 93.4 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.963 -0.542 . . . . 0.0 110.446 175.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.28 -54.86 38.64 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 124.014 0.925 . . . . 0.0 108.824 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -67.46 0.8 2.7 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.347 1.059 . . . . 0.0 113.066 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -122.14 7.16 9.71 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.425 1.011 . . . . 0.0 113.19 169.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 20.2 ptt180 -118.4 13.28 13.54 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.563 1.145 . . . . 0.0 111.52 170.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 23.3 p -129.92 -7.12 4.46 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.235 1.414 . . . . 0.0 111.958 -176.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.947 0 N-CA-C 104.332 -3.507 . . . . 0.0 104.332 -169.866 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.012 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 14.1 m170 73.52 -53.26 0.7 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 127.263 2.225 . . . . 0.0 113.623 171.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 18.1 ptm -151.21 17.47 0.75 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 124.121 0.969 . . . . 0.0 110.767 169.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . 0.414 ' CZ ' ' CD2' ' A' ' 688' ' ' PHE . 11.8 m-85 -136.4 171.4 8.79 Favored Pre-proline 0 C--O 1.243 0.752 0 C-N-CA 127.182 2.193 . . . . 0.0 106.419 177.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -38.1 150.29 0.06 OUTLIER 'Trans proline' 0 C--N 1.353 0.791 0 C-N-CA 123.933 3.089 . . . . 0.0 113.668 169.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.3 m -44.13 -41.55 5.73 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 125.711 1.604 . . . . 0.0 114.847 -169.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -69.74 -81.37 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 127.289 2.236 . . . . 0.0 112.084 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.7 pt -53.08 114.14 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 C-N-CA 127.212 2.205 . . . . 0.0 112.842 -169.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -66.9 145.44 98.92 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 168.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -59.48 -31.63 94.99 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.075 1.85 . . . . 0.0 112.142 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -66.51 -45.87 78.1 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 -179.034 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 45.0 t -59.96 -42.36 89.2 Favored 'Isoleucine or valine' 0 C--N 1.342 0.281 0 C-N-CA 123.642 0.777 . . . . 0.0 109.435 174.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.414 ' CD2' ' CZ ' ' A' ' 679' ' ' PHE . 72.8 t80 -62.25 -39.64 93.52 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.905 -0.569 . . . . 0.0 111.544 -176.039 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -82.28 -16.09 50.68 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.19 0.904 . . . . 0.0 112.334 179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -71.28 -23.3 61.94 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 123.497 0.719 . . . . 0.0 110.346 169.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 85.5 mt -58.69 147.17 72.05 Favored Pre-proline 0 CA--C 1.538 0.482 0 O-C-N 121.115 -0.991 . . . . 0.0 109.604 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_exo -54.92 147.78 50.21 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 122.457 2.105 . . . . 0.0 110.476 178.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -49.46 -48.31 47.68 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.481 0.712 . . . . 0.0 111.466 -175.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.37 -26.24 64.57 Favored 'General case' 0 N--CA 1.449 -0.516 0 N-CA-C 113.707 1.002 . . . . 0.0 113.707 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 69.7 t -71.4 -37.97 66.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-N 118.889 0.768 . . . . 0.0 109.277 172.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -64.36 -47.45 79.27 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 122.565 1.174 . . . . 0.0 107.849 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.03 -46.35 91.06 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.276 -1.329 . . . . 0.0 109.893 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -65.79 -39.88 91.39 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-N 118.733 0.697 . . . . 0.0 111.138 -179.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.46 -40.23 96.58 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.198 0.908 . . . . 0.0 110.396 175.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 47.5 mt -66.9 -39.81 87.52 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.463 -0.773 . . . . 0.0 110.528 175.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -63.87 -38.45 91.15 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.606 0.639 . . . . 0.0 110.512 174.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -62.19 -54.57 39.09 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.694 1.197 . . . . 0.0 108.428 177.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.5 m0 -66.5 -6.6 15.43 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.246 -0.909 . . . . 0.0 113.225 176.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . 0.499 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.2 OUTLIER -108.96 1.56 20.75 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 117.979 -1.01 . . . . 0.0 113.06 169.735 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 17.2 ptt180 -117.92 -3.08 11.2 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.751 1.221 . . . . 0.0 112.661 169.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 38.7 p -116.16 -8.12 11.79 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.578 1.551 . . . . 0.0 110.973 174.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.255 1.458 0 C-N-CA 130.099 3.714 . . . . 0.0 104.091 169.624 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.471 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -154.53 178.63 9.86 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.561 -0.904 . . . . 0.0 108.561 174.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 7.0 tpt -113.06 -168.83 1.38 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.489 1.915 . . . . 0.0 106.948 170.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . 0.401 ' CD1' HD11 ' A' ' 683' ' ' ILE . 22.0 m-30 -44.59 113.28 1.66 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.216 1.006 . . . . 0.0 110.609 169.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -55.34 -34.35 88.42 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.905 3.07 . . . . 0.0 115.853 -173.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 29.0 m 115.11 -6.35 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 130.971 3.709 . . . . 0.0 109.916 -170.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 34.1 p-10 -68.7 -13.72 62.55 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.507 1.923 . . . . 0.0 111.019 168.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . 0.425 HD12 ' CD1' ' A' ' 688' ' ' PHE . 10.1 pt -135.2 146.57 30.05 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.992 0 C-N-CA 127.258 2.223 . . . . 0.0 109.342 -176.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -91.23 143.89 29.02 Favored Pre-proline 0 CA--C 1.541 0.615 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 167.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_exo -57.62 -40.38 80.51 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.718 2.279 . . . . 0.0 112.561 -174.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -68.35 -43.85 76.53 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 -176.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.38 -40.52 88.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.143 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 84.2 t80 -58.66 -38.64 78.62 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 121.681 -0.637 . . . . 0.0 112.096 176.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -80.68 -15.91 55.34 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 118.858 0.754 . . . . 0.0 112.727 -179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 53.8 tt0 -73.36 -19.97 60.88 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 119.333 0.97 . . . . 0.0 110.813 169.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.77 148.82 66.82 Favored Pre-proline 0 CA--C 1.536 0.411 0 O-C-N 120.905 -1.122 . . . . 0.0 109.463 172.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -54.34 147.29 46.99 Favored 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 122.483 2.122 . . . . 0.0 110.576 178.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . 0.431 ' CD ' ' HZ3' ' A' ' 697' ' ' LYS . 45.1 tp10 -38.11 -58.56 0.95 Allowed 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 125.461 1.504 . . . . 0.0 110.945 179.389 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.83 -25.09 62.68 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -173.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.41 -43.47 87.61 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 CA-C-N 119.351 0.978 . . . . 0.0 108.595 173.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.458 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 66.7 mt-30 -57.49 -45.5 84.83 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . 0.431 ' HZ3' ' CD ' ' A' ' 693' ' ' GLU . 11.5 mptt -71.78 -33.89 68.98 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 118.234 -0.889 . . . . 0.0 110.529 -174.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 23.7 tp10 -66.63 -46.45 75.79 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.324 1.05 . . . . 0.0 111.213 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.63 -43.08 99.52 Favored 'General case' 0 N--CA 1.461 0.097 0 O-C-N 121.412 -0.805 . . . . 0.0 110.168 177.198 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 36.2 mt -60.01 -41.07 91.33 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.928 -0.482 . . . . 0.0 111.008 172.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -59.48 -48.14 82.79 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 117.666 -1.159 . . . . 0.0 109.806 175.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -62.05 -45.63 92.72 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 120.348 1.431 . . . . 0.0 111.449 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 31.1 m0 -63.62 -14.13 48.74 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 120.501 -1.374 . . . . 0.0 112.506 175.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.6 OUTLIER -101.74 -17.85 16.08 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.726 1.211 . . . . 0.0 112.928 169.56 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 55.6 mtt180 -67.77 -41.29 83.5 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 121.412 1.915 . . . . 0.0 109.033 171.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 17.7 p -73.38 24.33 0.07 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.913 2.085 . . . . 0.0 113.539 -172.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 N-CA-C 108.713 -1.755 . . . . 0.0 108.713 -172.26 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 683' ' ' ILE . . . . . . . . 0 N--CA 1.464 0.562 0 N-CA-C 112.268 -0.333 . . . . 0.0 112.268 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 41.4 p-80 -132.24 -19.84 2.46 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.766 1.226 . . . . 0.0 109.939 169.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 25.5 ptm -137.15 19.99 2.98 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.464 0.706 . . . . 0.0 111.624 169.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -147.33 156.13 46.15 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 128.682 2.793 . . . . 0.0 104.803 169.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . 0.279 0.0 OUTLIER -12.15 -88.18 0.0 OUTLIER 'Trans proline' 0 C--N 1.353 0.791 1 C-N-CA 126.723 4.949 . . . . 0.0 118.664 -171.661 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 69.0 m -158.76 -39.33 0.06 Allowed 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 119.785 1.175 . . . . 0.0 110.507 177.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . 0.447 ' CG ' ' H ' ' A' ' 683' ' ' ILE . 19.0 p-10 -75.75 -74.22 0.23 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.541 1.536 . . . . 0.0 108.688 171.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . 0.447 ' H ' ' CG ' ' A' ' 682' ' ' ASP . 6.2 pt -58.44 156.53 2.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.152 0 C-N-CA 126.422 1.889 . . . . 0.0 111.681 -176.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -141.68 169.9 10.28 Favored Pre-proline 0 C--N 1.331 -0.201 0 C-N-CA 125.786 1.634 . . . . 0.0 106.806 169.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -55.29 -36.2 93.06 Favored 'Trans proline' 0 CA--C 1.506 -0.905 0 C-N-CA 122.567 2.178 . . . . 0.0 113.81 -168.64 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -63.14 -56.08 19.81 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 11.9 t -61.78 -37.39 77.97 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.095 0 C-N-CA 124.305 1.042 . . . . 0.0 109.546 -173.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 75.8 t80 -75.32 -40.83 58.02 Favored 'General case' 0 N--CA 1.441 -0.908 0 C-N-CA 123.345 0.658 . . . . 0.0 111.341 -176.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -82.05 -14.1 56.36 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.059 0.845 . . . . 0.0 110.934 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -74.36 -9.67 58.83 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.834 1.254 . . . . 0.0 110.325 168.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 54.3 mt -76.34 152.92 83.96 Favored Pre-proline 0 CA--C 1.534 0.339 0 O-C-N 121.499 -0.751 . . . . 0.0 109.144 170.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -55.6 146.7 63.23 Favored 'Trans proline' 0 N--CA 1.455 -0.749 0 C-N-CA 122.755 2.303 . . . . 0.0 110.653 177.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.0 tp10 -46.39 -49.81 17.44 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 124.249 1.02 . . . . 0.0 111.943 -176.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.46 -28.12 66.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.316 -0.85 . . . . 0.0 113.237 -177.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 90.6 t -68.93 -38.05 78.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 118.922 0.783 . . . . 0.0 109.406 172.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.43 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 72.8 mt-30 -63.99 -47.7 79.33 Favored 'General case' 0 N--CA 1.457 -0.113 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 -178.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -60.58 -46.54 89.85 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.08 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -62.66 -43.11 99.64 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.11 0.964 . . . . 0.0 111.63 -178.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.0 -39.27 90.16 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.385 0.674 . . . . 0.0 110.247 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 36.0 mt -63.4 -41.37 98.75 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 118.909 0.777 . . . . 0.0 110.243 172.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -60.81 -43.75 97.78 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.958 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 20.5 tp10 -61.35 -47.09 87.49 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 119.371 0.987 . . . . 0.0 110.825 177.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 25.0 m0 -68.93 0.05 4.96 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.315 -0.866 . . . . 0.0 112.618 173.197 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . 0.513 ' HZ2' ' C ' ' A' ' 707' ' ' GLY . 1.2 tppm? -117.56 3.66 12.41 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.358 1.463 . . . . 0.0 112.175 168.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -95.17 -11.4 28.17 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.911 1.285 . . . . 0.0 109.53 168.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 17.1 p -122.58 -3.68 8.79 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.565 1.146 . . . . 0.0 113.69 -168.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . 0.513 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.251 1.162 0 N-CA-C 106.158 -2.777 . . . . 0.0 106.158 -175.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.595 0 CA-C-O 118.983 -0.899 . . . . 0.0 111.679 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . 0.4 ' CG ' ' H ' ' A' ' -1' ' ' MET 0.289 0.0 OUTLIER 40.82 -130.47 0.4 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 127.958 2.503 . . . . 0.0 114.421 172.72 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . 0.4 ' H ' ' CG ' ' A' ' -2' ' ' HIS . 0.0 OUTLIER -101.26 -159.74 0.75 Allowed 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.655 1.982 . . . . 0.0 108.671 -179.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -47.29 130.46 9.86 Favored Pre-proline 0 CA--C 1.535 0.403 0 C-N-CA 125.115 1.366 . . . . 0.0 111.64 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -54.5 -14.09 6.56 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.797 2.998 . . . . 0.0 113.642 169.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . 0.258 26.6 m 76.06 8.0 3.54 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 127.152 2.181 . . . . 0.0 113.291 174.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 13.3 p-10 -74.76 -40.05 61.43 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 167.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 14.1 pt -76.0 127.22 37.32 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.791 0 C-N-CA 127.204 2.202 . . . . 0.0 107.92 168.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -72.49 141.6 83.08 Favored Pre-proline 0 CA--C 1.543 0.677 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 167.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -57.84 -37.47 96.2 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.499 2.133 . . . . 0.0 112.057 -173.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -69.26 -42.75 75.15 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 64.9 t -59.75 -40.15 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 C-N-CA 123.359 0.664 . . . . 0.0 109.455 176.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.442 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 74.4 t80 -62.7 -42.41 99.63 Favored 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 121.378 -0.826 . . . . 0.0 112.016 176.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 37.9 m-85 -75.96 -12.03 60.07 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.941 0.791 . . . . 0.0 112.182 -178.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -73.43 -20.75 60.64 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.446 1.021 . . . . 0.0 110.12 168.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 87.3 mt -60.07 151.04 67.84 Favored Pre-proline 0 CA--C 1.536 0.439 0 O-C-N 120.885 -1.134 . . . . 0.0 109.205 172.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -54.93 148.06 48.93 Favored 'Trans proline' 0 N--CA 1.452 -0.935 0 C-N-CA 122.607 2.205 . . . . 0.0 110.446 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . 0.459 ' CD ' ' HZ3' ' A' ' 697' ' ' LYS . 45.8 tp10 -41.32 -57.47 2.13 Favored 'General case' 0 C--N 1.333 -0.111 0 C-N-CA 125.055 1.342 . . . . 0.0 111.262 -179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.8 -27.96 66.33 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -174.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 98.9 t -67.76 -45.1 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 176.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.442 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 70.0 mt-30 -55.36 -44.5 76.06 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 122.024 0.916 . . . . 0.0 109.318 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . 0.459 ' HZ3' ' CD ' ' A' ' 693' ' ' GLU . 9.1 mptt -69.87 -41.37 74.9 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 117.622 -1.18 . . . . 0.0 110.347 -171.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -69.9 -43.77 71.07 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 119.614 1.097 . . . . 0.0 111.022 -179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -56.39 -46.56 80.06 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.877 0.762 . . . . 0.0 110.941 174.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 32.2 mt -69.03 -33.97 74.47 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.472 -0.767 . . . . 0.0 111.461 178.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -69.99 -34.74 73.74 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-N 119.257 0.935 . . . . 0.0 110.903 176.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 31.9 tp10 -67.73 -51.81 44.86 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.349 1.06 . . . . 0.0 109.007 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 24.1 m0 -59.94 -34.09 72.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 120.965 -1.084 . . . . 0.0 110.9 176.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . 0.465 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.3 OUTLIER -74.99 -35.63 62.03 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 117.666 -1.159 . . . . 0.0 112.777 175.173 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 7.3 ptp85 -74.71 -14.02 60.68 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 120.877 1.671 . . . . 0.0 111.899 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 36.0 p -103.7 18.94 20.82 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.279 1.032 . . . . 0.0 111.938 -178.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.856 0 CA-C-O 117.188 -1.895 . . . . 0.0 108.724 179.098 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . 0.452 ' HA3' ' CG ' ' A' ' 684' ' ' ASP . . . . . . . . 0 N--CA 1.46 0.282 0 N-CA-C 110.622 -0.991 . . . . 0.0 110.622 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 38.2 p-80 -138.37 -9.83 1.46 Allowed 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.171 1.388 . . . . 0.0 112.569 -175.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 24.8 ttt -127.54 7.33 6.32 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.811 1.244 . . . . 0.0 110.556 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -147.44 177.18 1.86 Allowed Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 127.64 2.376 . . . . 0.0 106.282 177.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_exo -40.19 163.28 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.873 3.048 . . . . 0.0 116.127 169.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 3.8 m -49.68 -29.87 8.14 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.732 1.613 . . . . 0.0 115.121 -169.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -90.15 -68.5 0.78 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 125.664 1.586 . . . . 0.0 110.789 177.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.5 pt -66.61 162.1 3.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 C-N-CA 125.877 1.671 . . . . 0.0 113.083 -171.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . 0.452 ' CG ' ' HA3' ' A' ' -3' ' ' GLY . 0.7 OUTLIER -140.84 166.29 23.81 Favored Pre-proline 0 N--CA 1.468 0.467 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 169.684 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -56.9 -34.67 97.57 Favored 'Trans proline' 0 CA--C 1.505 -0.958 0 C-N-CA 122.533 2.156 . . . . 0.0 113.666 -168.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -63.38 -55.71 22.19 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -178.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 17.6 t -65.93 -34.46 70.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 C-N-CA 124.218 1.007 . . . . 0.0 109.431 -173.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.431 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 79.5 t80 -70.74 -41.74 71.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 121.893 -0.504 . . . . 0.0 111.495 179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 30.6 m-85 -82.63 -13.75 55.93 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.232 0.924 . . . . 0.0 111.015 -179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -71.59 -17.17 62.3 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.36 1.064 . . . . 0.0 109.954 168.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 70.4 mt -66.55 152.51 94.83 Favored Pre-proline 0 C--N 1.344 0.364 0 O-C-N 121.199 -0.938 . . . . 0.0 109.765 174.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -55.06 147.12 54.92 Favored 'Trans proline' 0 N--CA 1.455 -0.794 0 C-N-CA 123.023 2.482 . . . . 0.0 110.252 176.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 30.4 tp10 -46.62 -50.74 17.11 Favored 'General case' 0 CA--C 1.519 -0.213 0 C-N-CA 124.181 0.993 . . . . 0.0 112.436 -172.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -63.32 -39.0 93.35 Favored 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 57.8 t -61.23 -38.09 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 O-C-N 121.357 -0.839 . . . . 0.0 109.531 178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.431 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 60.8 mt-30 -64.0 -48.12 77.65 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.222 0.465 . . . . 0.0 110.468 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.6 -48.53 80.52 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -176.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.51 -37.03 76.99 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 122.736 0.414 . . . . 0.0 110.344 -173.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.55 -42.53 91.75 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 118.829 0.741 . . . . 0.0 110.192 175.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.03 -40.68 94.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 118.796 0.725 . . . . 0.0 110.711 175.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.59 -38.23 70.89 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.57 0.623 . . . . 0.0 111.912 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 39.8 tp10 -69.42 -41.65 76.07 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.43 1.092 . . . . 0.0 110.099 -179.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 29.0 m0 -61.31 -45.33 94.91 Favored 'General case' 0 N--CA 1.452 -0.37 0 O-C-N 121.185 -0.947 . . . . 0.0 109.087 170.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.5 tptp -60.83 -24.51 65.93 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 119.504 1.047 . . . . 0.0 112.96 176.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 6.2 ttp85 -73.01 -11.73 60.67 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.307 1.043 . . . . 0.0 112.166 175.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.57 -13.46 1.99 Allowed 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -168.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.848 0 N-CA-C 105.072 -3.211 . . . . 0.0 105.072 170.188 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . 0.45 ' H1 ' ' C ' ' A' ' 707' ' ' GLY . . . . . . . . 0 C--O 1.224 -0.516 0 N-CA-C 107.683 -2.167 . . . . 0.0 107.683 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 49.4 m80 -73.85 25.95 0.07 Allowed 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 118.63 1.215 . . . . 0.0 113.529 -175.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 11.3 tpt -155.92 153.51 29.75 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.941 2.096 . . . . 0.0 105.906 170.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -53.26 132.83 52.0 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-O 117.654 -1.165 . . . . 0.0 107.903 170.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -52.88 -25.09 26.29 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.453 2.102 . . . . 0.0 113.441 170.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 15.2 m 67.27 15.45 9.97 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.88 1.672 . . . . 0.0 113.692 173.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 22.0 p-10 -76.76 -41.09 46.15 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.605 1.562 . . . . 0.0 107.577 168.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.1 pt -81.89 139.2 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.914 0 C-N-CA 128.021 2.528 . . . . 0.0 108.301 169.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -73.57 144.2 83.2 Favored Pre-proline 0 CA--C 1.542 0.66 0 N-CA-C 105.754 -1.943 . . . . 0.0 105.754 168.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -60.66 -38.07 74.66 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 121.727 1.618 . . . . 0.0 111.526 -175.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -63.62 -47.39 81.61 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 179.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 58.4 t -61.71 -37.12 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 -176.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.43 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 86.5 t80 -62.83 -47.49 83.2 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.389 -0.82 . . . . 0.0 112.235 171.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 36.3 m-85 -74.22 -14.22 60.9 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 121.204 -0.935 . . . . 0.0 111.701 -177.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -73.82 -14.54 61.11 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.676 1.19 . . . . 0.0 110.646 169.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 77.3 mt -64.77 152.74 89.64 Favored Pre-proline 0 CA--C 1.537 0.445 0 O-C-N 121.022 -1.049 . . . . 0.0 109.697 172.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_exo -55.3 144.07 73.17 Favored 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 123.139 2.559 . . . . 0.0 109.945 177.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -44.94 -50.09 10.71 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.613 1.165 . . . . 0.0 112.079 -174.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.46 -32.3 73.05 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -177.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 97.4 t -67.11 -40.1 84.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 176.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.43 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 74.0 mt-30 -62.54 -48.67 78.51 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.267 -1.382 . . . . 0.0 107.267 -177.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -45.04 79.53 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 117.809 -1.091 . . . . 0.0 110.114 -175.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -67.5 -43.18 81.52 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.02 0.827 . . . . 0.0 111.598 -179.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . 0.411 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 2.0 mm? -63.06 -35.98 82.07 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 120.988 -1.07 . . . . 0.0 112.249 174.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 39.9 mt -69.7 -38.2 76.88 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 177.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -66.48 -36.84 83.76 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.684 -0.674 . . . . 0.0 110.352 173.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -63.8 -54.08 40.8 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.528 1.131 . . . . 0.0 109.456 176.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . 0.411 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 31.3 m0 -62.36 -25.34 67.86 Favored 'General case' 0 N--CA 1.447 -0.577 0 O-C-N 120.846 -1.159 . . . . 0.0 111.587 177.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . 0.471 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.5 OUTLIER -81.39 -32.81 32.66 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 117.177 -1.392 . . . . 0.0 112.766 173.28 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -82.34 -27.51 32.16 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.977 1.717 . . . . 0.0 111.432 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 27.9 p -86.72 155.36 20.39 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 176.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . 0.45 ' C ' ' H1 ' ' A' ' -3' ' ' GLY . . . . . . . . 0 C--O 1.247 0.91 0 N-CA-C 107.422 -2.271 . . . . 0.0 107.422 168.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.149 0 CA-C-O 118.835 -0.98 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -132.76 -3.25 3.27 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 118.039 0.919 . . . . 0.0 112.32 -169.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -172.35 -47.91 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.95 2.1 . . . . 0.0 105.59 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . 0.428 ' CZ ' ' CD2' ' A' ' 688' ' ' PHE . 24.8 m-85 -76.74 170.64 15.23 Favored Pre-proline 0 CA--C 1.549 0.916 0 C-N-CA 124.501 1.12 . . . . 0.0 108.24 168.136 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -39.47 161.09 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.898 0 C-N-CA 125.008 3.805 . . . . 0.0 116.446 171.144 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 5.8 m -45.62 -35.78 4.3 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 126.604 1.962 . . . . 0.0 115.849 -169.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -81.26 -61.98 1.79 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 119.621 1.1 . . . . 0.0 110.494 174.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.23 168.34 0.91 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-O 125.247 2.451 . . . . 0.0 114.512 -169.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -146.56 148.95 35.52 Favored Pre-proline 0 C--N 1.322 -0.613 0 C-N-CA 129.288 3.035 . . . . 0.0 104.551 -173.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_exo -59.97 -33.63 95.51 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 CA-C-N 121.892 1.712 . . . . 0.0 112.516 -174.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -63.61 -50.45 69.32 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 109.074 -0.714 . . . . 0.0 109.074 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 29.9 t -64.51 -38.61 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 C-N-CA 123.674 0.79 . . . . 0.0 109.086 -178.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.428 ' CD2' ' CZ ' ' A' ' 679' ' ' PHE . 70.3 t80 -68.07 -40.93 82.6 Favored 'General case' 0 N--CA 1.444 -0.762 0 O-C-N 121.632 -0.667 . . . . 0.0 111.658 -177.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 35.8 m-85 -81.57 -14.48 56.76 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 118.989 0.813 . . . . 0.0 111.811 -179.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -67.91 -24.67 65.23 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.671 0.789 . . . . 0.0 109.747 169.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 55.6 mt -63.28 148.53 93.09 Favored Pre-proline 0 CA--C 1.537 0.459 0 O-C-N 121.604 -0.685 . . . . 0.0 109.546 173.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -55.62 147.87 57.18 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.726 2.284 . . . . 0.0 110.691 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 28.8 tp10 -47.59 -49.71 26.01 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 123.879 0.872 . . . . 0.0 111.718 -175.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -67.54 -27.24 66.8 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -177.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 97.0 t -71.66 -36.74 60.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-N 118.826 0.739 . . . . 0.0 109.386 173.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 67.9 mt-30 -65.0 -44.83 87.93 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-O 122.248 1.023 . . . . 0.0 108.493 -178.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.13 -50.74 70.69 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.184 178.764 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -65.18 -38.34 90.2 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 122.955 0.502 . . . . 0.0 111.421 -176.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.85 -42.29 95.01 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 119.986 1.266 . . . . 0.0 110.083 177.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 57.0 mt -63.95 -36.5 84.18 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.329 0.513 . . . . 0.0 110.832 175.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -71.26 -37.75 71.93 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 123.379 0.672 . . . . 0.0 111.123 176.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -65.91 -50.95 62.62 Favored 'General case' 0 CA--C 1.516 -0.343 0 C-N-CA 125.037 1.335 . . . . 0.0 108.65 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 30.4 m0 -57.51 -48.25 79.76 Favored 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 121.561 -0.712 . . . . 0.0 109.151 174.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 3.6 tpmp? -69.12 -11.0 60.4 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-O 117.329 -1.319 . . . . 0.0 113.928 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -105.09 6.06 32.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 121.45 1.932 . . . . 0.0 111.839 173.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 34.8 p -125.66 -17.17 5.55 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.028 0.931 . . . . 0.0 111.861 176.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 N-CA-C 106.856 -2.497 . . . . 0.0 106.856 169.991 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.852 0 CA-C-O 118.624 -1.098 . . . . 0.0 112.347 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . 0.268 0.0 OUTLIER 52.92 2.11 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 131.321 3.848 . . . . 0.0 118.954 176.16 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 25.6 ptm -161.43 -1.19 0.05 Allowed 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 115.509 1.67 . . . . 0.0 115.509 -170.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . 0.421 ' CD1' ' HD2' ' A' ' 680' ' ' PRO . 0.4 OUTLIER -100.92 157.75 33.09 Favored Pre-proline 0 CA--C 1.541 0.613 0 CA-C-N 120.2 1.364 . . . . 0.0 110.089 -169.669 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . 0.421 ' HD2' ' CD1' ' A' ' 679' ' ' PHE . 6.2 Cg_exo -54.57 138.79 75.54 Favored 'Trans proline' 0 CA--C 1.535 0.552 0 C-N-CA 121.927 1.752 . . . . 0.0 110.846 168.423 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 16.9 m 46.78 24.79 0.37 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.066 1.347 . . . . 0.0 112.92 -170.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . 0.374 12.2 t0 32.25 41.0 0.02 OUTLIER 'General case' 0 C--O 1.233 0.234 0 C-N-CA 129.537 3.135 . . . . 0.0 116.114 -169.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 4.5 pt -53.13 148.62 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 122.797 1.284 . . . . 0.0 109.343 169.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -70.84 135.9 85.44 Favored Pre-proline 0 N--CA 1.444 -0.729 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 170.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -55.19 -36.69 93.83 Favored 'Trans proline' 0 N--CA 1.453 -0.905 0 C-N-CA 121.854 1.703 . . . . 0.0 111.452 179.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -64.94 -44.5 89.28 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 -176.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 51.4 t -69.06 -42.58 82.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 -179.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -56.56 -45.11 81.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.157 -0.964 . . . . 0.0 113.444 173.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -84.93 -5.75 59.34 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 118.763 0.71 . . . . 0.0 111.587 -174.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -77.04 -22.38 53.05 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.783 1.233 . . . . 0.0 109.252 168.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 91.3 mt -58.98 150.55 60.44 Favored Pre-proline 0 CA--C 1.534 0.346 0 O-C-N 121.389 -0.82 . . . . 0.0 109.968 175.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_exo -53.49 147.63 37.42 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 123.253 2.635 . . . . 0.0 110.631 177.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -48.73 -48.59 40.45 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 123.602 0.761 . . . . 0.0 111.428 -174.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -69.85 -25.79 63.9 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -178.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 89.3 t -70.9 -43.77 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.341 0 CA-C-N 119.288 0.949 . . . . 0.0 108.858 172.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -58.52 -47.26 84.73 Favored 'General case' 0 C--O 1.231 0.1 0 CA-C-N 118.66 0.664 . . . . 0.0 109.314 178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.72 -43.26 97.06 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 117.973 -1.013 . . . . 0.0 109.904 -179.219 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -66.8 -39.14 87.64 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 119.255 0.934 . . . . 0.0 111.038 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -42.87 96.2 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 121.409 -0.807 . . . . 0.0 109.467 176.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 32.2 mt -63.79 -40.97 97.94 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.967 0.803 . . . . 0.0 110.911 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -62.52 -40.92 98.32 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.726 -0.655 . . . . 0.0 110.337 175.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -60.13 -54.46 45.61 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 26.9 m0 -66.99 0.23 2.69 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.524 1.13 . . . . 0.0 113.261 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . 0.504 ' HZ2' ' C ' ' A' ' 707' ' ' GLY . 1.2 tppm? -125.55 10.91 7.91 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.786 -1.196 . . . . 0.0 113.63 169.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 20.6 ptt180 -117.99 13.91 14.03 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.714 1.206 . . . . 0.0 110.542 169.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 24.7 p -131.92 -7.41 3.52 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.148 1.779 . . . . 0.0 111.518 -175.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . 0.504 ' C ' ' HZ2' ' A' ' 704' ' ' LYS . . . . . . . . 0 C--O 1.253 1.289 0 N-CA-C 104.665 -3.374 . . . . 0.0 104.665 -169.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.955 0 CA-C-O 117.271 -1.85 . . . . 0.0 116.008 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 57.2 t60 65.19 -44.43 0.35 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 118.493 2.775 . . . . 0.0 118.493 174.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -154.82 171.39 19.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 120.589 1.541 . . . . 0.0 109.665 -172.681 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -60.25 132.89 90.42 Favored Pre-proline 0 CA--C 1.544 0.735 0 N-CA-C 107.725 -1.213 . . . . 0.0 107.725 171.082 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -62.21 -160.61 0.03 OUTLIER 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 124.528 3.485 . . . . 0.0 112.108 168.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 14.4 m -148.58 17.73 1.03 Allowed 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.413 -1.429 . . . . 0.0 111.736 176.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -87.71 -38.66 15.63 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.375 1.47 . . . . 0.0 109.219 169.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 12.9 pt -83.9 145.26 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 C-N-CA 124.845 1.258 . . . . 0.0 110.669 170.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -84.3 142.59 40.92 Favored Pre-proline 0 CA--C 1.541 0.632 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 168.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -74.77 -29.0 9.13 Favored 'Trans proline' 0 N--CA 1.449 -1.12 0 CA-C-N 120.286 1.138 . . . . 0.0 111.064 -171.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 59.5 tp60 -69.14 -43.76 73.71 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 119.481 1.037 . . . . 0.0 109.09 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 92.2 t -56.58 -44.82 81.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 174.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.403 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 90.7 t80 -59.58 -43.14 93.72 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 175.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -78.13 -13.08 60.0 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 119.761 1.164 . . . . 0.0 112.367 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -82.09 -7.01 59.6 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.019 0.928 . . . . 0.0 110.933 168.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 71.8 mt -65.61 152.91 91.75 Favored Pre-proline 0 CA--C 1.534 0.354 0 O-C-N 121.036 -1.04 . . . . 0.0 109.083 169.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_exo -55.2 145.99 62.5 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 123.074 2.516 . . . . 0.0 110.511 178.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 32.3 tp10 -46.21 -50.18 16.16 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.267 1.027 . . . . 0.0 112.09 -174.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -68.88 -29.47 67.77 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -177.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 94.2 t -68.04 -41.34 84.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.403 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.3 mt-30 -63.31 -46.68 85.55 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 -177.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -40.9 85.74 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-O 117.393 -1.289 . . . . 0.0 110.57 -175.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -69.8 -43.69 71.56 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 119.921 1.237 . . . . 0.0 111.146 179.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . 0.456 HD12 ' CZ2' ' A' ' 703' ' ' TRP . 1.5 mm? -61.76 -42.87 99.55 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 121.132 -0.98 . . . . 0.0 111.041 177.345 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 27.5 mt -64.69 -39.52 93.81 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.394 0.543 . . . . 0.0 110.696 176.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -56.38 -55.97 26.94 Favored 'General case' 0 C--O 1.211 -0.926 0 CA-C-O 115.968 -1.968 . . . . 0.0 108.537 170.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -49.32 -49.16 45.22 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 122.558 2.436 . . . . 0.0 110.122 175.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . 0.456 ' CZ2' HD12 ' A' ' 699' ' ' LEU . 44.4 m0 -70.56 -4.51 23.4 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -175.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . . . . . . . . . 1.7 tppm? -135.67 -5.97 2.21 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 121.148 1.795 . . . . 0.0 115.029 169.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -77.19 -37.51 53.42 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 127.184 2.194 . . . . 0.0 109.095 170.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.52 61.34 0.72 Allowed 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 -168.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.039 0 N-CA-C 109.364 -1.494 . . . . 0.0 109.364 -169.619 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.362 0 N-CA-C 108.795 -1.722 . . . . 0.0 108.795 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' HIS . . . . . . . . . . . . . 84.6 t60 -146.7 169.05 19.83 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 106.516 -1.661 . . . . 0.0 106.516 170.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' MET . . . . . . . . . . . . . 12.5 tpt -56.22 -22.73 31.19 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.006 0.923 . . . . 0.0 113.038 -172.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 679' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -147.11 152.95 44.52 Favored Pre-proline 0 N--CA 1.449 -0.483 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 168.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 680' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -60.48 -36.78 84.97 Favored 'Trans proline' 0 C--N 1.348 0.543 0 C-N-CA 122.816 2.344 . . . . 0.0 112.297 177.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 681' ' ' SER . . . . . . . . . . . . . 19.3 m 116.93 16.57 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 131.528 3.931 . . . . 0.0 110.39 -178.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 682' ' ' ASP . . . . . . . . . . . . . 25.0 p-10 -114.97 -37.94 4.03 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.761 1.624 . . . . 0.0 112.808 -169.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 683' ' ' ILE . . . . . . . . . . . . . 2.3 pt -92.1 138.65 19.42 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.723 1.209 . . . . 0.0 111.617 -173.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 684' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -65.69 138.75 96.77 Favored Pre-proline 0 CA--C 1.542 0.649 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 168.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.61 -28.12 10.2 Favored 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 121.278 1.319 . . . . 0.0 111.165 -169.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 686' ' ' GLN . . . . . . . . . . . . . 23.6 mm100 -69.1 -46.77 66.91 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 119.484 1.038 . . . . 0.0 108.436 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 687' ' ' VAL . . . . . . . . . . . . . 89.3 t -57.99 -36.03 54.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 CA-C-O 119.169 -0.443 . . . . 0.0 110.339 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 688' ' ' PHE . . . . . 0.409 ' CZ ' ' HA ' ' A' ' 696' ' ' GLN . 73.0 t80 -68.89 -53.04 23.4 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 119.363 0.983 . . . . 0.0 113.608 169.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 689' ' ' TYR . . . . . . . . . . . . . 31.0 m-85 -75.87 -10.64 59.6 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.968 -1.082 . . . . 0.0 112.954 -169.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 690' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -83.91 -1.87 55.37 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.808 1.243 . . . . 0.0 111.196 169.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 691' ' ' LEU . . . . . . . . . . . . . 58.7 mt -70.59 156.65 91.63 Favored Pre-proline 0 CA--C 1.535 0.397 0 O-C-N 120.859 -1.151 . . . . 0.0 109.415 169.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 692' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -56.33 142.77 87.92 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.251 2.634 . . . . 0.0 110.696 177.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 693' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.02 -36.06 67.54 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.688 0.795 . . . . 0.0 112.948 -172.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 694' ' ' ALA . . . . . . . . . . . . . . . -70.96 -33.27 70.29 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.297 -0.877 . . . . 0.0 113.093 175.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 695' ' ' VAL . . . . . . . . . . . . . 75.5 t -65.11 -43.34 95.78 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.444 -0.946 . . . . 0.0 108.444 173.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.409 ' HA ' ' CZ ' ' A' ' 688' ' ' PHE . 75.4 mt-30 -56.48 -53.12 61.21 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 697' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -53.45 -41.36 66.06 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 118.089 -0.958 . . . . 0.0 113.03 -179.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 698' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -67.2 -42.31 84.37 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 118.75 0.705 . . . . 0.0 110.193 179.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 699' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -66.08 -36.21 82.59 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 120.999 -1.063 . . . . 0.0 112.569 174.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 700' ' ' LEU . . . . . . . . . . . . . 84.0 mt -60.56 -44.51 96.08 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.711 1.141 . . . . 0.0 108.753 172.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 701' ' ' ALA . . . . . . . . . . . . . . . -61.06 -44.99 96.55 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-O 117.729 -1.129 . . . . 0.0 109.511 177.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 702' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.13 -46.17 90.54 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 119.937 1.244 . . . . 0.0 110.437 177.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 703' ' ' TRP . . . . . . . . . . . . . 38.9 m0 -64.72 -14.1 57.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 O-C-N 120.653 -1.28 . . . . 0.0 112.099 177.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 704' ' ' LYS . . . . . 0.489 ' HE2' ' HA ' ' A' ' 704' ' ' LYS . 0.5 OUTLIER -103.64 -17.33 15.19 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 117.749 -1.119 . . . . 0.0 112.51 168.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 705' ' ' ARG . . . . . . . . . . . . . 80.7 mtm-85 -69.72 -40.68 76.09 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 121.41 1.914 . . . . 0.0 109.244 169.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 706' ' ' THR . . . . . . . . . . . . . 20.7 p -77.21 29.79 0.14 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.075 1.75 . . . . 0.0 113.244 -169.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 707' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.642 0 N-CA-C 108.763 -1.735 . . . . 0.0 108.763 -170.6 . . . . . . . . 0 0 . 1 stop_ save_