data_6v4t_residue ############################ # Computer software used # ############################ 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 6v4t _Structure_validation_residue.Date_analyzed 2020-03-27 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 ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 12.1 tp -171.22 144.93 2.12 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.339 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -161.59 148.85 14.6 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.261 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.73 -19.73 6.89 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.584 179.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -75.1 -37.56 61.45 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.314 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -68.94 -39.6 79.48 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.784 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -68.24 -49.74 58.65 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.263 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.42 -40.58 77.17 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.128 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 26.1 t -60.93 -35.69 77.37 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.846 178.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 6.6 mt -57.58 -19.88 28.62 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.331 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -68.64 -2.84 9.99 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -64.24 -48.94 73.89 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.37 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.6 -23.12 13.51 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.409 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 54.37 1.71 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -63.92 -53.53 48.9 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 119.217 0.917 . . . . 0.0 111.722 -179.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 8.8 tp -69.28 -32.11 52.35 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.27 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 18.5 m -58.5 -39.13 79.2 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.951 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -60.35 -41.17 93.06 Favored 'General case' 0 C--O 1.211 -0.923 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -71.97 -22.16 61.48 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.974 178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.96 -16.46 35.75 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.69 26.44 5.59 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 119.963 -0.695 . . . . 0.0 112.329 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -130.37 -41.14 1.24 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 10.6 tt -66.53 -36.97 78.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.999 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -48.38 76.78 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 36.9 mt -60.19 -37.45 73.43 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.899 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -28.71 18.72 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.861 -178.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.68 -50.52 78.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.948 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 58.1 mt -58.22 -42.01 82.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.592 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 88.5 mt -58.88 -41.17 82.1 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 92.3 t -67.37 -17.96 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.018 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.13 -65.04 3.54 Favored Glycine 0 C--N 1.35 1.328 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 178.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 48.7 m -54.51 -29.51 50.63 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.772 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.9 tp -55.75 -41.77 74.45 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.926 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -71.03 -37.08 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.114 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.73 -40.6 98.68 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 110.124 -1.191 . . . . 0.0 110.124 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 3.2 tt -56.44 -31.66 64.15 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-O 120.655 0.265 . . . . 0.0 111.549 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 42.1 mmt-85 -50.45 -34.56 25.2 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 2.4 pp -57.48 -40.38 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -175.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 18.9 m -55.81 -28.33 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 119.263 -0.975 . . . . 0.0 110.965 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -55.65 -36.27 66.85 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.038 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.85 -47.64 79.9 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 63.1 t -66.04 -44.54 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.85 -29.51 70.8 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.928 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 35.4 t -64.41 -42.66 95.96 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.9 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.1 -30.03 39.11 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.072 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.77 -22.67 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -60.72 -24.68 65.86 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.665 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -73.7 -11.59 60.45 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.038 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 61.9 t -107.34 -36.13 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 53.6 ttm-85 -127.91 145.62 50.89 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.65 -179.836 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 N--CA 1.497 1.914 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -162.84 150.61 13.66 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -167.44 -175.87 3.02 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.442 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 10.6 tt -53.55 -40.14 65.3 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.501 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -74.35 -30.63 62.09 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.481 0.488 . . . . 0.0 112.044 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 5.4 tptp -70.37 -46.36 64.23 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -66.92 -39.64 87.42 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.366 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.25 -23.36 67.03 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.742 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -31.97 73.21 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.533 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 61.1 mt -77.45 -4.22 44.33 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 10.7 m0 -68.62 -5.19 18.63 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -89.11 -49.78 6.55 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 119.208 -0.997 . . . . 0.0 111.238 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . 0.423 ' O ' ' N ' ' B' ' 674' ' ' ASP . 1.2 p90 -104.27 -23.62 13.21 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.918 177.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 53.6 p90 34.5 25.73 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.401 1.259 . . . . 0.0 114.401 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' B' ' 672' ' ' TRP . 72.5 m-20 -63.65 -53.08 56.98 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 119.786 -0.765 . . . . 0.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tp -69.1 -31.58 50.72 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.05 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.1 m -58.8 -36.4 74.4 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.681 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -60.49 -45.9 92.06 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.595 -0.442 . . . . 0.0 109.817 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -70.83 -45.97 63.58 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.534 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 75.6 mt -67.35 -2.79 6.66 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 119.939 -0.704 . . . . 0.0 111.795 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.3 t90 -117.69 142.78 46.85 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 72.6 13.27 5.34 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -36.35 61.16 Favored 'Isoleucine or valine' 0 C--N 1.354 0.764 0 CA-C-N 119.585 1.084 . . . . 0.0 110.419 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.8 mtm105 -55.43 -43.76 75.65 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.904 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 88.2 mt -60.45 -42.75 92.28 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.753 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -55.81 -43.78 77.24 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.32 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.75 -40.52 82.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 120.267 -0.573 . . . . 0.0 109.644 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 90.8 mt -58.77 -41.53 82.83 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.482 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 26.0 mm -58.75 -43.94 89.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 61.3 t -68.45 -9.51 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.161 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -78.08 -39.1 24.55 Favored Glycine 0 C--N 1.351 1.389 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 16.5 m -80.9 -19.83 43.49 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.802 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.82 -40.93 94.58 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.901 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -60.19 -40.4 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.579 -179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -68.3 -43.66 78.3 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 119.566 -1.302 . . . . 0.0 111.238 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.92 -38.54 73.02 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 116.906 0.353 . . . . 0.0 111.481 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -50.77 -30.17 13.4 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 44.8 mm -58.24 -39.85 75.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 119.435 -0.317 . . . . 0.0 111.225 -176.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 6.4 p -54.97 -26.95 18.33 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 C-N-CA 120.614 -0.435 . . . . 0.0 111.007 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -54.29 -24.8 20.41 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.57 -34.9 18.93 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 121.337 -0.145 . . . . 0.0 111.092 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 35.2 m -59.33 -31.34 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.55 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.9 tt -58.24 -41.62 84.58 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.592 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 26.7 t -64.82 -37.55 87.99 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -55.28 -43.98 75.26 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -176.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 27.1 m -71.1 -10.8 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 120.022 -0.671 . . . . 0.0 112.676 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.58 -14.05 17.81 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 119.427 -0.909 . . . . 0.0 110.84 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -73.95 -24.04 59.59 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 121.281 -0.167 . . . . 0.0 111.171 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 40.2 t -85.28 -36.07 10.58 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.275 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -68.64 -176.38 0.8 Allowed 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.498 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 118.004 -0.998 . . . . 0.0 111.067 179.855 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 17.7 mt . . . . . 0 N--CA 1.494 1.757 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -85.12 121.87 28.51 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.152 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -162.42 161.43 27.24 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.382 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 8.8 tt -52.91 -40.5 63.62 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.133 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -62.98 -31.87 73.08 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 123.834 0.709 . . . . 0.0 111.616 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -69.79 -41.17 75.44 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.047 -179.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -61.92 -49.33 76.61 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.449 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.54 -31.87 72.86 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.431 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 7.6 t -67.88 -32.68 73.33 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.604 0.24 . . . . 0.0 111.184 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 11.2 tp -57.66 -15.86 8.93 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.284 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -68.7 -2.61 9.63 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 118.981 -0.533 . . . . 0.0 112.35 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -65.03 -50.39 66.45 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 119.318 -0.953 . . . . 0.0 112.995 -177.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -103.81 6.17 36.45 Favored 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 56.6 -29.39 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 118.943 2.942 . . . . 0.0 118.943 175.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.61 -54.6 33.38 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 121.519 1.963 . . . . 0.0 113.336 -175.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 1.6 mm -69.75 -27.77 34.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 119.119 -1.032 . . . . 0.0 110.113 177.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 18.8 m -58.55 -49.82 76.03 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -70.15 -42.79 72.08 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -69.19 -26.48 64.86 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.69 -32.93 71.82 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -126.58 18.43 7.44 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 114.495 1.295 . . . . 0.0 114.495 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -125.28 0.27 7.73 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.98 177.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 7.0 tp -68.56 -36.16 73.42 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 120.599 0.237 . . . . 0.0 111.524 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.07 -37.14 66.38 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.026 -0.533 . . . . 0.0 112.125 -176.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.95 -48.66 85.11 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.828 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -59.22 -30.13 68.02 Favored 'General case' 0 C--O 1.218 -0.575 0 O-C-N 123.387 0.429 . . . . 0.0 111.093 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.89 -46.0 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.116 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 63.8 mt -60.17 -41.68 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.823 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 3.5 mp -57.05 -40.89 75.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 51.2 t -66.95 -17.6 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 119.844 -0.742 . . . . 0.0 111.431 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -70.32 -62.8 3.52 Favored Glycine 0 C--N 1.351 1.384 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.05 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 4.5 m -51.85 -25.39 7.77 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 117.365 0.583 . . . . 0.0 112.01 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.4 tp -53.77 -34.3 58.62 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.001 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.7 pp -79.18 -33.32 15.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.787 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.937 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.92 -48.54 85.11 Favored Glycine 0 CA--C 1.543 1.795 0 C-N-CA 120.68 -0.771 . . . . 0.0 111.691 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -56.57 -31.84 64.62 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.5 -34.19 24.17 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 20.0 tt -57.64 -41.22 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-O 118.639 -0.696 . . . . 0.0 112.681 -174.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 5.6 p -56.49 -28.87 27.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.028 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -34.84 69.7 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.303 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.75 -34.83 63.05 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -175.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 35.4 m -59.15 -31.24 45.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.459 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tt -58.64 -27.89 65.15 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.834 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 19.6 m -58.43 -38.33 77.21 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.497 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 14.2 tp -59.43 -35.23 73.64 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.441 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 9.9 t -84.9 -17.87 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.289 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.24 -25.92 66.02 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 34.2 mtm105 -73.85 -45.78 48.99 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.96 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 45.3 t -88.61 -12.59 10.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.254 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.508 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.842 0 CA-C-O 119.695 -0.193 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 7.6 mp 55.88 177.87 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.527 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -169.92 147.7 3.36 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.269 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.1 tt -61.65 -40.24 94.21 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.528 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -73.98 -23.95 59.54 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.491 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 15.2 tmtt? -64.88 -42.16 95.03 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 121.059 -0.257 . . . . 0.0 111.136 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -69.1 -53.27 21.15 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.328 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.55 84.89 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.875 -178.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 40.4 t -58.75 -31.77 68.63 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.743 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 47.7 tp -58.73 -25.68 63.19 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.306 -178.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -68.29 -5.55 19.18 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 119.045 -1.062 . . . . 0.0 111.429 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -63.1 -40.31 97.27 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.972 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -83.42 -22.75 32.59 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.591 -178.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 42.9 t80 64.99 -67.25 0.12 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -56.04 -52.73 63.2 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -68.58 -28.42 40.13 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.767 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.477 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.0 m -58.97 -46.39 88.18 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.882 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -62.35 -47.38 84.48 Favored 'General case' 0 C--O 1.213 -0.824 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.737 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -64.88 -37.46 87.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.784 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 8.5 tp -67.98 -8.86 40.88 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.3 t-105 -139.3 0.86 1.94 Allowed 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -102.5 0.42 33.59 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 119.889 -0.724 . . . . 0.0 112.125 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.8 pp -55.93 -36.84 45.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.628 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.283 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -67.48 -48.51 66.93 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.946 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 86.3 mt -62.74 -43.67 98.87 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.921 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -52.81 -29.07 25.52 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.781 -179.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 16.9 mm -58.69 -38.97 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.923 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 10.8 mt -58.01 -41.75 81.08 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 80.8 mt -56.99 -41.28 77.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 177.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 43.3 t -68.04 -0.35 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.345 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -81.1 -34.92 25.42 Favored Glycine 0 C--N 1.349 1.272 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 178.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 13.3 m -75.81 -30.74 59.14 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 116.889 0.345 . . . . 0.0 111.101 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.79 -33.12 54.97 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.944 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 1.7 pp -70.58 -37.23 69.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 120.101 -0.64 . . . . 0.0 110.033 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.81 -43.27 98.09 Favored Glycine 0 C--O 1.214 -1.095 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.7 -42.19 78.7 Favored 'General case' 0 C--O 1.211 -0.953 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.553 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -50.48 -35.25 28.24 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.18 -40.19 76.37 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.77 -177.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 13.2 m -55.82 -28.35 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 118.384 0.538 . . . . 0.0 110.829 -179.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -58.45 -36.54 73.84 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.651 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.9 -50.81 72.06 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.175 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 11.1 p -68.83 -32.08 53.29 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.18 178.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.0 tp -58.77 -27.36 64.91 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.223 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 48.3 t -58.0 -45.32 87.03 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.423 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.3 -40.97 97.02 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.92 -28.39 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.435 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -60.81 -14.8 24.03 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -39.72 63.84 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.435 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 28.5 t -105.54 10.43 9.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.532 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 66.54 -76.07 0.05 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 122.237 -0.29 . . . . 0.0 110.531 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.468 179.924 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 54.13 90.61 0.03 OUTLIER 'General case' 0 C--O 1.22 -0.461 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.933 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -143.79 147.52 34.26 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.398 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -27.4 18.57 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.463 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -74.23 -40.62 62.3 Favored 'General case' 0 C--O 1.22 -0.487 0 O-C-N 123.275 0.359 . . . . 0.0 111.147 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -65.26 -46.09 81.91 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.393 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -64.92 -43.86 91.4 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 120.779 -0.369 . . . . 0.0 111.005 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.28 -31.0 72.04 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.311 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 34.4 t -55.62 -31.45 62.29 Favored 'General case' 0 C--O 1.219 -0.502 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.892 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 11.2 mp -71.44 -8.77 56.01 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -74.17 -26.79 60.5 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -63.01 -43.8 97.77 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.563 -178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.22 -23.17 13.64 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.699 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 14.6 t80 50.42 6.27 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 178.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -63.66 -53.84 45.1 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 119.578 1.081 . . . . 0.0 110.992 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 7.0 tp -69.67 -29.83 42.65 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.911 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.844 177.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 13.1 m -59.04 -41.24 87.37 Favored 'General case' 0 C--O 1.214 -0.809 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.716 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -62.64 -47.35 84.1 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.268 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 3.0 t90 -72.47 -45.48 59.34 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.369 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 8.3 tp -74.47 -29.38 61.42 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 19.1 t90 -86.77 -14.82 41.22 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 120.152 -0.619 . . . . 0.0 112.016 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -103.94 10.81 36.11 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.238 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 30.9 pt -62.64 -41.27 91.55 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.3 ttp-105 -63.69 -45.55 89.53 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.749 -0.381 . . . . 0.0 110.734 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.0 -40.08 82.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.38 -30.93 42.32 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.473 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 22.5 mm -59.8 -50.06 81.48 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.136 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 73.7 mt -62.12 -42.15 93.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 79.6 mt -60.8 -42.67 93.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 87.0 t -68.73 -1.67 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.405 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -105.84 6.71 41.02 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.624 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 38.6 m -88.7 -34.27 17.25 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 117.414 0.607 . . . . 0.0 111.583 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.07 -35.12 76.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.417 -178.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -33.54 57.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.956 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.05 -44.06 37.67 Favored Glycine 0 C--O 1.214 -1.103 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.75 -41.62 77.87 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 121.323 -0.151 . . . . 0.0 110.836 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 28.0 mmt180 -51.03 -31.3 17.93 Favored 'General case' 0 C--O 1.214 -0.773 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.53 -40.68 82.57 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.26 -177.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 54.0 t -56.04 -28.21 24.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 119.551 -0.261 . . . . 0.0 110.889 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -55.44 -26.82 44.27 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 120.023 -0.671 . . . . 0.0 111.276 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -53.12 -36.82 61.18 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 120.639 -0.424 . . . . 0.0 109.943 178.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.57 -43.15 98.13 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.534 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.7 tt -63.33 -40.69 98.01 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.578 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.4 t -60.36 -32.75 71.57 Favored 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.287 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.86 -40.19 94.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.86 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.76 -19.5 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.684 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -60.85 -17.72 51.78 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.718 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 8.6 tpp85 -73.9 -41.43 62.13 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 46.1 t -92.21 -36.25 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.152 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 18.8 ttm105 -142.74 151.74 41.59 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.945 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.034 -0.984 . . . . 0.0 111.131 179.871 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.86 121.01 27.9 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.216 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -161.25 162.64 31.18 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.079 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 9.3 tt -58.03 -40.03 79.84 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.538 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -74.01 -23.95 59.51 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.511 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -44.36 76.08 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.232 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -62.67 -49.98 72.98 Favored 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 120.671 -0.412 . . . . 0.0 111.087 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.0 -30.56 59.7 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.509 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.8 m -61.59 -32.32 72.42 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.454 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -67.32 -8.83 35.42 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -68.63 -22.39 64.42 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.758 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.09 -42.65 99.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 2.6 m95 -80.02 -22.75 42.06 Favored 'General case' 0 CA--C 1.558 1.269 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 63.27 -69.4 0.07 Allowed 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 120.068 1.304 . . . . 0.0 114.204 178.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -50.9 -52.37 42.55 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -176.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 7.3 tp -68.56 -28.49 40.44 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.006 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.6 m -58.81 -43.76 90.64 Favored 'General case' 0 C--O 1.22 -0.475 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.167 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -60.36 -47.02 87.84 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 120.326 -0.549 . . . . 0.0 109.8 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 41.8 t90 -57.55 -41.34 80.81 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.135 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 53.4 mt -73.62 -19.67 60.8 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -112.57 1.8 15.97 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -120.74 -7.9 9.53 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.542 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 8.0 tp -58.51 -36.62 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.998 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 49.3 ttp180 -55.8 -48.2 75.8 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.455 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -67.77 -46.75 81.85 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.572 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -52.74 -30.03 30.3 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 123.248 0.343 . . . . 0.0 111.067 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.82 -45.79 91.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 52.7 mt -62.74 -41.65 93.21 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 2.1 mp -56.49 -40.89 70.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 87.2 t -66.81 -22.17 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.899 -176.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.02 -5.43 87.66 Favored Glycine 0 CA--C 1.555 2.568 0 CA-C-N 119.93 1.241 . . . . 0.0 113.34 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 67.4 m -88.76 -34.5 17.1 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.97 1.385 . . . . 0.0 113.046 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.85 -31.68 50.39 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.049 -178.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -33.87 60.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.73 -37.14 89.3 Favored Glycine 0 CA--C 1.54 1.626 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 4.1 tt -56.39 -30.85 63.25 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -49.42 -36.3 21.78 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 2.2 pp -59.89 -41.92 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.964 0.802 . . . . 0.0 112.609 -177.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -28.85 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 118.523 -1.271 . . . . 0.0 110.282 -179.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -35.54 81.26 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -179.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.68 -35.48 66.08 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -176.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 34.1 m -59.77 -31.52 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 120.063 -0.655 . . . . 0.0 111.515 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.5 pp -58.47 -28.77 65.63 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.178 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.3 m -58.04 -41.42 83.22 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.337 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 24.9 tp -62.23 -33.56 74.82 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 23.0 t -69.87 -27.25 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.609 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -60.94 -7.01 2.11 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 64.0 ttt-85 -73.81 -42.51 60.81 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 3.1 t -102.68 26.08 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.673 179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.687 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.694 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 45.9 mt . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.34 -155.93 0.2 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.083 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 78.25 168.6 0.21 Allowed 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 117.961 0.346 . . . . 0.0 110.706 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 3.4 tt -52.3 -22.57 4.64 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.204 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -69.47 -45.54 68.77 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.322 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -70.4 -41.33 73.15 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.7 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -64.56 -38.8 92.27 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.116 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.33 78.82 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 120.293 -0.563 . . . . 0.0 112.487 -178.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 11.5 t -57.39 -32.6 66.98 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.144 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 15.3 tp -58.76 -23.1 59.47 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.177 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -79.22 -2.99 43.62 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 118.274 -0.87 . . . . 0.0 112.954 -177.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.23 -50.68 37.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 117.987 -1.485 . . . . 0.0 111.906 -177.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -104.9 -22.13 13.2 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-O 120.714 0.292 . . . . 0.0 110.546 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 47.9 p90 40.22 23.28 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 178.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -62.81 -52.68 62.23 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.51 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.4 tp -68.59 -27.35 35.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.685 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 25.8 m -58.03 -36.15 72.32 Favored 'General case' 0 C--N 1.347 0.483 0 C-N-CA 120.367 -0.533 . . . . 0.0 109.719 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -59.94 -47.5 85.56 Favored 'General case' 0 C--O 1.219 -0.5 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 177.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 76.6 t90 -61.73 -19.86 62.88 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.224 177.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.5 tp -94.03 -8.5 39.68 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 120.362 -0.535 . . . . 0.0 112.011 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -128.33 21.38 6.16 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 120.367 -0.533 . . . . 0.0 112.123 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -132.41 -40.24 1.0 Allowed 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 178.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -38.77 80.34 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.744 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -59.28 -48.17 82.61 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.528 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -62.06 -45.61 98.35 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -52.72 -27.56 18.15 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 32.7 mm -57.33 -50.52 76.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 C-N-CA 120.161 -0.616 . . . . 0.0 110.581 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 44.0 mt -58.94 -42.03 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 119.614 -0.834 . . . . 0.0 109.854 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 81.8 mt -56.65 -40.91 72.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.483 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 88.8 t -67.25 -16.02 20.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.864 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -72.32 -26.4 72.11 Favored Glycine 0 CA--C 1.539 1.542 0 N-CA-C 110.087 -1.205 . . . . 0.0 110.087 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -86.33 -19.84 29.22 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.671 0.236 . . . . 0.0 111.094 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.39 -40.9 88.08 Favored 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.266 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.53 -33.89 62.48 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.185 179.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -68.0 -43.22 82.92 Favored Glycine 0 C--O 1.213 -1.203 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 4.5 tt -55.96 -31.45 62.99 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-O 121.071 0.462 . . . . 0.0 110.697 178.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 -50.34 -35.28 27.09 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.35 -40.49 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 10.8 m -55.79 -28.02 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 119.5 -0.88 . . . . 0.0 111.204 -177.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -55.28 -36.82 66.55 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.644 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.1 -48.92 77.44 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 88.4 t -65.65 -39.73 85.82 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 7.2 tt -60.9 -33.1 72.6 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.701 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 21.7 t -64.29 -45.22 88.96 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.208 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 16.5 tp -81.23 -34.09 32.4 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 1.8 p -60.87 -18.67 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.697 -178.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -66.26 -12.51 56.76 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 -73.78 -38.58 64.61 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.381 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 2.8 m -95.87 23.53 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.135 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 29.6 ttm180 -96.94 -59.16 1.86 Allowed 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 117.825 -1.084 . . . . 0.0 110.095 179.842 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 6.7 mp -125.64 92.33 3.58 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.217 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -140.09 160.89 38.93 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.295 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.73 -39.94 68.77 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.688 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -72.63 -32.23 65.75 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.848 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -46.2 64.62 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -72.81 -32.53 65.6 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.383 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.77 -38.12 79.83 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.676 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 26.5 t -59.63 -32.39 70.39 Favored 'General case' 0 C--O 1.218 -0.602 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.817 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 7.9 mt -57.57 -19.41 25.39 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.94 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -68.69 -2.88 10.22 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 119.909 -0.716 . . . . 0.0 112.511 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -81.39 -49.43 10.67 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.918 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.1 p90 -104.23 -23.08 13.29 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.516 177.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 49.7 p90 38.05 25.33 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 178.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -63.63 -53.59 49.02 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.606 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 5.8 tp -69.17 -41.22 81.26 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.394 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.2 m -59.01 -50.57 73.58 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.586 -178.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.52 -33.39 75.81 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 120.061 -0.655 . . . . 0.0 111.029 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . 0.422 ' O ' HG12 ' B' ' 682' ' ' ILE . 15.1 t-105 -72.13 -47.12 53.45 Favored 'General case' 0 C--O 1.209 -1.058 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.43 -17.14 35.07 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -176.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 4.2 t90 -69.49 0.72 4.83 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.718 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -126.71 -17.19 5.06 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . 0.422 HG12 ' O ' ' B' ' 678' ' ' TRP . 49.3 mm -59.34 -46.21 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 119.113 -0.47 . . . . 0.0 112.049 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 7.4 ptt-85 -56.51 -44.04 80.35 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.222 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 86.4 mt -67.73 -42.92 86.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.26 -28.18 26.31 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.989 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 29.9 mm -58.15 -49.7 80.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 C-N-CA 120.864 -0.335 . . . . 0.0 111.132 -178.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 49.9 mt -57.57 -41.73 79.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.1 -42.06 82.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.204 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 57.4 t -68.61 -3.04 2.29 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.17 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.013 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.92 -36.83 10.79 Favored Glycine 0 C--N 1.346 1.096 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.54 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 71.0 m -75.09 -27.04 59.73 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 117.077 0.439 . . . . 0.0 111.045 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 mp -53.5 -32.22 49.41 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.982 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 1.6 pp -74.7 -38.17 44.35 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.712 0 C-N-CA 119.886 -0.725 . . . . 0.0 111.155 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.47 -55.24 28.57 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.584 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . 0.431 ' CD2' ' C ' ' B' ' 695' ' ' LEU . 0.0 OUTLIER -56.56 -28.32 59.9 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 117.298 0.549 . . . . 0.0 111.988 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -46.68 -28.49 1.5 Allowed 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 123.022 0.529 . . . . 0.0 112.089 -177.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 6.9 tp -57.33 -39.17 66.31 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.217 0 CA-C-O 118.958 -0.544 . . . . 0.0 111.553 -177.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 28.7 m -54.88 -28.28 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-N 119.124 0.875 . . . . 0.0 111.548 -178.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -55.21 -25.8 35.34 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -50.5 -50.16 53.63 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.503 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 31.0 m -68.03 -32.06 54.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.646 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.1 tt -63.46 -26.97 68.97 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.586 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 40.2 m -63.29 -34.49 77.8 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.285 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 20.0 tp -61.83 -43.19 99.34 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.109 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 81.3 t -65.45 -10.93 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.124 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -76.82 -21.65 54.76 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.633 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.46 -38.97 16.78 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 121.367 -0.133 . . . . 0.0 111.019 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 11.4 p -88.15 25.55 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.301 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 46.7 ttt85 -60.07 138.78 57.8 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.503 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.705 -179.866 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 N--CA 1.493 1.721 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.88 134.92 16.18 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.951 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -168.55 151.84 5.49 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.081 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -29.18 62.06 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.264 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -74.17 -27.19 60.71 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.677 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.89 -39.25 76.37 Favored 'General case' 0 C--O 1.219 -0.535 0 O-C-N 123.355 0.409 . . . . 0.0 110.812 -179.282 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.8 m95 -63.69 -52.16 61.84 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.4 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -51.89 -34.34 40.84 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 37.4 m -59.12 -34.41 72.01 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.944 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 10.8 mp -78.07 -9.71 59.27 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 11.7 m0 -68.66 -26.24 65.21 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.115 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -62.78 -42.61 99.78 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -79.58 -22.17 44.09 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -177.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 69.08 -44.2 0.53 Allowed 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.895 1.225 . . . . 0.0 113.063 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -57.56 -52.8 63.93 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 118.431 0.56 . . . . 0.0 111.585 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.61 -30.34 46.95 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.531 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.2 m -58.73 -45.24 90.08 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.577 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -78.42 -22.37 47.85 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.932 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -56.37 -22.12 29.15 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.143 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.27 -33.15 13.35 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.903 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -97.89 24.37 7.0 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.632 -179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -133.03 -39.4 0.95 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . 0.436 HG21 HD13 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -61.15 -45.62 98.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.51 0 CA-C-N 116.325 -0.398 . . . . 0.0 109.99 178.498 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 30.8 ttp180 -59.29 -46.71 87.82 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 121.237 0.541 . . . . 0.0 110.257 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 80.0 mt -67.88 -36.47 75.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.468 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.41 -28.98 14.33 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -175.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 2.2 mp -60.03 -39.98 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 119.474 -0.891 . . . . 0.0 109.059 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 46.5 mt -58.72 -41.51 82.61 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 34.3 mm -59.8 -44.15 93.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.526 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 53.6 t -68.18 -24.15 29.62 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.118 0 CA-C-O 118.924 -0.56 . . . . 0.0 112.149 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.6 -61.23 7.72 Favored Glycine 0 C--N 1.354 1.535 0 N-CA-C 110.149 -1.181 . . . . 0.0 110.149 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 45.4 m -57.33 -31.52 65.78 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.585 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -60.8 -47.17 87.54 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.676 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -73.09 -34.34 44.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 119.986 -0.685 . . . . 0.0 109.959 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.82 -43.4 96.59 Favored Glycine 0 CA--C 1.54 1.628 0 C-N-CA 120.665 -0.778 . . . . 0.0 111.335 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.22 -31.29 63.36 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 117.004 0.402 . . . . 0.0 110.572 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 21.6 mmm180 -49.81 -34.69 20.32 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.89 -40.12 74.73 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -175.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 8.7 p -54.9 -28.43 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.148 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -60.32 -35.68 76.19 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.05 -39.08 71.48 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.817 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 86.2 t -62.49 -31.86 53.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.115 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 12.7 tp -58.69 -37.03 75.19 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.452 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 10.3 p -57.83 -35.56 71.05 Favored 'General case' 0 C--O 1.219 -0.521 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.844 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.6 tp -58.86 -37.04 75.63 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.811 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 16.3 t -76.28 -16.23 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.201 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -63.12 -28.87 70.36 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 48.2 ptt85 -86.42 -37.36 18.42 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.314 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 33.6 m -90.95 -1.76 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.276 0.472 . . . . 0.0 112.276 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 12.9 mmp_? . . . . . 0 N--CA 1.471 0.606 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.718 179.561 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 34.0 mt -74.78 177.92 5.85 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -169.75 168.94 8.73 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.417 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 8.9 tt -61.59 -40.14 93.72 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.671 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.19 -24.43 62.23 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.738 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -66.54 -46.03 77.48 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.244 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -73.19 -51.96 15.89 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.21 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.38 -22.63 54.49 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.772 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 13.6 t -60.41 -32.58 71.48 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.298 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -71.4 -14.22 62.1 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.41 -0.516 . . . . 0.0 112.061 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -68.97 -12.69 61.9 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.95 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -62.65 -48.23 80.22 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.231 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.71 -22.61 15.32 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.094 179.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 9.7 t80 59.02 -0.34 0.14 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -63.53 -53.03 58.26 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 118.894 0.77 . . . . 0.0 110.867 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.05 -31.61 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.826 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.3 m -58.69 -44.95 90.44 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.76 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -60.64 -41.55 95.16 Favored 'General case' 0 C--O 1.215 -0.721 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.589 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 11.1 t90 -71.17 -27.66 63.69 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.375 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.5 -15.15 31.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -111.13 -5.26 14.78 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -118.42 -11.11 10.03 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.569 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 15.3 tt -66.83 -38.91 82.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.748 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -56.48 -48.33 77.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 120.056 -0.657 . . . . 0.0 109.436 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 82.0 mt -63.7 -46.88 93.45 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -29.09 24.43 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.36 -43.34 86.16 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.191 -179.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 46.7 mt -58.68 -41.45 82.35 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.259 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 42.5 mm -56.28 -41.31 70.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 46.3 t -68.09 -0.27 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 120.531 -0.467 . . . . 0.0 111.411 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -99.24 -31.94 5.99 Favored Glycine 0 CA--C 1.535 1.329 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.1 m -73.72 -16.86 61.18 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.853 0.327 . . . . 0.0 111.232 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.0 -40.14 80.02 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.224 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.61 -35.42 61.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.368 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.67 -47.78 83.51 Favored Glycine 0 C--N 1.347 1.159 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 4.6 tt -56.13 -31.68 63.55 Favored 'General case' 0 C--O 1.21 -1.013 0 CA-C-O 121.032 0.444 . . . . 0.0 110.793 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -50.52 -34.82 26.77 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.5 tp -58.04 -40.07 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -175.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 17.4 m -55.27 -28.04 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 118.807 0.73 . . . . 0.0 110.696 -178.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -55.76 -36.38 67.26 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.43 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.66 -50.51 73.58 Favored 'General case' 0 C--O 1.219 -0.536 0 O-C-N 123.291 0.369 . . . . 0.0 111.064 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 9.0 p -68.16 -33.99 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 120.491 -0.484 . . . . 0.0 109.939 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.58 -36.99 83.99 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 178.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 66.8 m -64.4 -43.93 92.9 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.394 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 11.4 tp -81.01 -17.46 50.23 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 2.5 p -60.89 -29.24 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.226 -178.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -61.91 -11.12 11.48 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 52.5 ttt85 -73.68 -35.3 65.18 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 121.112 -0.235 . . . . 0.0 110.795 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 47.3 t -102.44 -36.19 4.33 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.531 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.18 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -162.39 154.7 19.14 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.899 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.105 -0.95 . . . . 0.0 110.83 179.972 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 12.5 tp . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 55.0 mt -135.93 149.49 48.95 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.358 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -178.6 174.47 1.2 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.3 -15.07 8.86 Favored 'General case' 0 C--O 1.211 -0.967 0 C-N-CA 119.041 -1.063 . . . . 0.0 111.06 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -66.25 -39.72 89.68 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -70.67 -46.42 63.22 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.743 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . 0.452 ' O ' ' HG ' ' B' ' 669' ' ' LEU . 77.0 m95 -73.19 -30.64 63.69 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -81.52 -10.74 59.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.542 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 5.7 t -75.23 -32.58 61.17 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 121.147 -0.221 . . . . 0.0 110.86 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' B' ' 666' ' ' TRP . 0.0 OUTLIER -65.29 -12.61 53.44 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.686 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 14.1 m95 -68.22 -19.41 64.74 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.112 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -89.46 -47.95 7.65 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 6.1 p-90 -103.16 -23.51 13.64 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 -177.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 51.15 -3.45 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 116.228 1.936 . . . . 0.0 116.228 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -53.27 55.69 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 120.217 1.371 . . . . 0.0 113.68 -177.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . 0.45 HD11 HG21 ' B' ' 675' ' ' ILE . 0.4 OUTLIER -68.32 -27.93 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 119.639 -0.825 . . . . 0.0 110.755 -179.688 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.3 m -59.11 -50.06 75.49 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.105 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -69.03 -20.95 64.14 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.542 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 8.2 t90 -72.19 -46.86 54.55 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.43 -10.45 32.42 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -92.55 -15.44 26.97 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 119.886 -0.725 . . . . 0.0 112.226 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -114.04 -31.53 6.33 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.43 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 23.8 mm -65.59 -44.66 93.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-O 119.24 -0.41 . . . . 0.0 111.48 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -42.7 76.63 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.172 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 84.4 mt -68.7 -41.96 82.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -52.79 -28.86 24.38 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.024 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.73 -37.61 67.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.5 mt -58.54 -41.87 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 2.7 mp -62.34 -41.28 91.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 47.2 t -67.86 -4.14 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.305 -179.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.46 -45.11 7.06 Favored Glycine 0 C--N 1.348 1.24 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 2.5 m -69.76 -22.9 63.31 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.856 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -54.34 -32.94 57.9 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.964 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 1.9 pp -65.2 -38.21 82.08 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.808 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.58 -51.73 49.43 Favored Glycine 0 C--O 1.213 -1.172 0 N-CA-C 111.15 -0.78 . . . . 0.0 111.15 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.72 -42.25 78.87 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -30.27 13.99 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 7.6 tp -58.63 -40.54 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -175.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.88 -28.03 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 118.306 0.503 . . . . 0.0 111.773 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -55.29 -26.98 43.71 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.275 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.77 -35.61 63.97 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.145 178.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 64.8 t -59.86 -32.73 50.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.926 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 1.1 pp -61.44 -30.79 70.8 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.296 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.6 t -58.1 -36.19 72.51 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.988 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.0 tp -63.93 -32.39 73.9 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.235 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 21.4 t -83.08 -33.71 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 120.969 -0.293 . . . . 0.0 110.375 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -65.28 -34.32 78.07 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.579 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.57 -33.54 62.7 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.56 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 9.9 p -111.11 26.11 3.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.292 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -49.35 111.21 0.46 Allowed 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.95 -0.3 . . . . 0.0 111.226 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.976 -179.888 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 3.4 mt -73.45 -172.01 1.1 Allowed 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -144.89 106.93 4.3 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.07 -33.12 68.71 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.359 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -60.55 -23.9 64.98 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.658 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -70.13 -41.68 73.6 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.15 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 76.2 m95 -73.05 -33.89 65.95 Favored 'General case' 0 C--O 1.214 -0.803 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.041 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -83.2 -30.75 27.51 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.013 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 3.3 p -56.23 -30.92 63.0 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.6 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -10.97 0.69 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -177.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -68.19 -31.1 70.39 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.451 -0.9 . . . . 0.0 109.915 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -83.29 -50.0 8.83 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 119.642 -0.823 . . . . 0.0 112.791 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 4.8 p-90 -97.94 -23.53 15.78 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 116.296 1.961 . . . . 0.0 116.296 -178.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 54.89 -7.38 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 121.453 1.933 . . . . 0.0 115.758 177.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -63.47 -53.06 58.04 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . 0.4 HD12 HG22 ' C' ' 675' ' ' ILE . 0.4 OUTLIER -69.08 -40.03 80.23 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 C-N-CA 118.88 -1.128 . . . . 0.0 112.617 -178.199 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 77.2 m -63.61 -33.78 76.37 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.926 -179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -64.79 -47.09 79.36 Favored 'General case' 0 C--O 1.21 -0.995 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.113 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 2.5 t90 -72.31 -45.99 57.61 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.154 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.57 -32.86 68.54 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -110.37 62.29 0.6 Allowed 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -173.92 -33.99 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.231 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 16.3 pt -55.19 -36.89 41.39 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.723 0 CA-C-O 119.324 -0.369 . . . . 0.0 111.88 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 10.9 mtp180 -56.69 -48.32 77.93 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.434 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 81.1 mt -67.56 -44.48 86.39 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.562 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.291 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -53.06 -28.45 24.81 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.907 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 14.8 mm -58.29 -40.11 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 120.023 -0.671 . . . . 0.0 110.098 -178.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.5 mt -59.78 -42.11 87.76 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.601 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 66.6 mt -65.1 -41.44 91.86 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.129 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 96.2 t -67.48 -22.34 28.61 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.171 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.872 -176.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.01 -4.13 90.36 Favored Glycine 0 CA--C 1.55 2.251 0 CA-C-N 119.668 1.122 . . . . 0.0 113.665 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 43.3 m -88.82 -34.7 16.95 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.76 1.28 . . . . 0.0 113.223 -178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . 0.404 ' CD1' ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -64.79 -31.75 73.12 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.073 -178.775 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . 0.404 ' N ' ' CD1' ' C' ' 692' ' ' LEU . 0.0 OUTLIER -69.03 -29.17 42.23 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 179.268 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.69 -40.85 95.38 Favored Glycine 0 CA--C 1.541 1.707 0 C-N-CA 120.193 -1.003 . . . . 0.0 110.97 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.3 tt -56.8 -34.08 67.31 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.27 -34.83 24.65 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.27 -40.69 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -175.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 8.2 p -56.02 -28.93 25.74 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.924 0 CA-C-N 119.187 0.903 . . . . 0.0 111.064 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.6 -35.45 70.45 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.759 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.7 -35.62 66.26 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -177.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.84 -31.47 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.799 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.4 pp -58.54 -25.52 62.56 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.943 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 74.2 m -57.85 -38.35 75.52 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.332 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -39.14 85.31 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.8 t -69.91 -18.82 22.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.868 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -60.67 -16.65 41.36 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -73.87 -37.57 64.7 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.703 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 21.0 t -96.46 9.5 6.17 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.801 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 15.2 tpp85 . . . . . 0 N--CA 1.473 0.691 0 O-C-N 122.267 -0.271 . . . . 0.0 110.874 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 10.1 tt . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 tp -150.72 -54.72 0.15 Allowed 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.393 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 48.42 177.39 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.33 -38.59 58.99 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 114.254 -1.339 . . . . 0.0 111.588 -178.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -60.97 -41.81 97.09 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -177.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 23.7 mmtp -71.11 -44.51 65.5 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 118.869 -1.133 . . . . 0.0 112.497 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -59.04 -39.2 81.26 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.955 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.23 -39.65 94.4 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.238 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 32.2 t -58.11 -32.68 68.34 Favored 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.557 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.7 -7.76 42.06 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.43 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 33.8 m0 -75.28 -6.75 51.44 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -62.57 -48.96 77.17 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.283 -179.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.72 -22.53 13.54 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 19.1 p90 49.67 -3.07 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -63.71 -53.55 49.38 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-N 120.355 1.434 . . . . 0.0 110.165 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 14.6 mm -69.43 -27.84 35.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.469 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 32.9 m -58.92 -48.63 80.79 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -64.92 -34.84 79.37 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 28.5 t90 -64.38 -19.91 65.79 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.765 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -84.96 -2.68 58.2 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 120.297 -0.561 . . . . 0.0 112.195 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 53.9 t-105 -145.16 -43.93 0.23 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 120.123 -0.631 . . . . 0.0 112.108 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -66.22 -13.08 59.76 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 13.7 pt -55.33 -36.15 39.39 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.721 0 C-N-CA 120.536 -0.465 . . . . 0.0 110.935 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -54.86 -32.77 61.08 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.894 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 45.2 mm -59.69 -48.28 88.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.066 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -67.82 -28.2 67.37 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 29.2 mm -58.12 -43.16 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.451 0.569 . . . . 0.0 111.853 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 63.4 mt -58.29 -41.88 82.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.024 -179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 47.5 mt -62.83 -41.49 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 60.5 t -68.21 -3.96 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -177.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -101.5 6.21 55.26 Favored Glycine 0 CA--C 1.543 1.794 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.846 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 14.6 m -88.31 -34.23 17.73 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 117.4 0.6 . . . . 0.0 111.781 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.0 -32.64 54.76 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.488 -178.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.75 -37.9 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.529 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.82 -36.82 74.91 Favored Glycine 0 C--O 1.212 -1.219 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.76 -36.44 69.79 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -52.76 -35.94 57.15 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 2.3 pp -59.15 -41.82 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 9.2 p -64.88 -29.57 47.79 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.815 0 C-N-CA 118.889 -1.124 . . . . 0.0 111.272 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -55.8 -35.57 66.46 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 121.129 -0.228 . . . . 0.0 110.897 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.91 -35.6 66.77 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.978 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 1.7 p -59.91 -33.11 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.914 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.6 tt -65.86 -29.84 70.35 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.182 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 42.3 p -57.59 -47.42 82.15 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.698 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.52 -39.39 94.31 Favored 'General case' 0 C--O 1.215 -0.719 0 CA-C-N 116.34 -0.391 . . . . 0.0 109.95 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 73.8 t -60.85 -15.38 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -80.23 -12.63 59.61 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -73.82 -27.79 61.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 120.091 -0.644 . . . . 0.0 111.579 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 39.1 t -82.81 -36.08 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.438 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.94 179.14 5.05 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.396 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.848 -179.936 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -108.3 119.18 38.75 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.936 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -137.98 162.08 35.02 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.381 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 10.6 tt -59.18 -40.17 84.84 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.932 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -73.79 -25.32 60.07 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.913 -179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -68.82 -46.15 69.36 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.783 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -64.52 -53.58 45.79 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 120.834 -0.347 . . . . 0.0 110.856 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.48 -23.13 56.99 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.116 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.92 -33.29 70.39 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.877 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 68.9 mt -65.03 -17.52 64.52 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -68.51 -2.9 9.79 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 120.612 -0.435 . . . . 0.0 112.002 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -73.32 -48.61 32.98 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.231 -0.588 . . . . 0.0 112.2 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . 0.413 ' C ' ' H ' ' B' ' 674' ' ' ASP . 0.0 OUTLIER -103.88 -23.17 13.4 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.82 179.898 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 42.8 t80 58.92 -12.25 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . 0.413 ' H ' ' C ' ' B' ' 672' ' ' TRP . 25.7 t0 -63.55 -52.56 60.58 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 119.345 0.975 . . . . 0.0 111.636 -179.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tp -68.46 -27.77 37.84 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.971 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.613 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 25.8 m -58.41 -41.77 85.71 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.405 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -45.56 92.15 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.827 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -72.14 -37.3 69.47 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.064 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.66 -3.09 42.31 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -120.37 -35.2 3.47 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 120.138 -0.625 . . . . 0.0 112.115 -178.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -66.52 -7.69 21.65 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.295 -0.562 . . . . 0.0 112.156 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . 0.44 HD12 HG21 ' B' ' 682' ' ' ILE . 0.2 OUTLIER -67.8 -46.27 82.72 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 119.926 -0.71 . . . . 0.0 112.535 -179.326 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 37.3 ptt180 -62.96 -42.8 99.93 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 118.58 0.627 . . . . 0.0 111.654 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 94.7 mt -65.7 -43.98 93.5 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -57.27 -34.18 68.39 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.22 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.72 -46.14 90.73 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 62.7 mt -58.65 -41.6 82.66 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.548 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 15.6 mm -59.64 -42.92 89.99 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.547 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 75.3 t -68.38 -15.74 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 CA-C-O 119.277 -0.392 . . . . 0.0 111.885 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -71.27 -54.18 9.36 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 44.1 m -64.44 -23.22 67.21 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.291 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.99 -32.77 55.09 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.565 -178.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 2.4 pp -65.3 -39.37 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.097 -178.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.18 -48.06 78.71 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.098 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.1 mt -56.83 -42.25 79.29 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 117.153 0.477 . . . . 0.0 111.9 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.48 -29.92 11.57 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 41.7 mm -58.44 -40.57 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 CA-C-O 119.023 -0.513 . . . . 0.0 111.679 -176.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 5.4 p -55.76 -28.16 23.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 118.652 0.66 . . . . 0.0 111.296 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -55.35 -26.84 43.37 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.346 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.66 54.23 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.006 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.99 -34.92 58.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.219 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.33 -35.23 73.44 Favored 'General case' 0 C--O 1.219 -0.522 0 O-C-N 123.007 0.192 . . . . 0.0 110.608 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.6 t -57.98 -31.85 67.31 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.855 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 6.9 tp -60.65 -42.5 97.11 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 61.1 t -73.69 -19.82 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -64.44 -8.63 14.2 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 28.2 mtt180 -73.96 -40.95 62.66 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.175 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 34.9 t -87.52 -36.19 9.34 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.784 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 -122.26 145.32 48.34 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.138 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 . . . . . 0 C--O 1.221 -0.424 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.683 -179.925 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 58.1 mt . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 2.1 tp -45.77 142.07 2.67 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 111.45 0.167 . . . . 0.0 111.45 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -169.7 165.69 9.97 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.197 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.09 -31.12 66.8 Favored 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.509 -179.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -74.22 -27.43 60.79 Favored 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -63.28 -42.31 99.08 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.321 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -58.74 -31.41 68.29 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.55 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.89 -16.17 6.25 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.513 178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 17.6 m -53.23 -32.96 50.86 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.45 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 11.9 tp -55.83 -13.44 1.78 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.841 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -69.59 -43.44 72.79 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -177.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -88.78 -52.01 5.35 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 117.25 -1.78 . . . . 0.0 113.67 -177.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . 0.258 6.0 p-90 -103.96 -21.96 13.55 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 178.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 2.2 t80 72.53 -27.77 0.19 Allowed 'General case' 0 C--N 1.373 1.622 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 175.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.26 -53.08 54.65 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -175.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 10.9 tp -69.76 -48.8 62.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 CA-C-N 120.946 1.703 . . . . 0.0 115.25 -176.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.8 m -61.27 -33.88 74.26 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 118.973 -1.091 . . . . 0.0 109.123 -178.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -62.84 -17.5 61.46 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.082 177.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 19.6 t90 -71.89 -44.66 63.37 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 7.5 mp -67.93 -2.77 8.07 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.596 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.35 168.85 18.16 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 78.49 -39.05 0.25 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.541 0.736 . . . . 0.0 110.711 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.77 -36.8 62.54 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -55.83 -44.47 77.96 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.061 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 44.3 mt -68.33 -36.81 76.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.347 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -52.01 -30.21 24.3 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.07 -42.98 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 65.6 mt -58.84 -41.22 82.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 46.5 mm -56.8 -41.86 76.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.495 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 57.4 t -67.81 -31.51 52.55 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 119.904 -0.719 . . . . 0.0 111.358 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.09 -47.68 72.18 Favored Glycine 0 C--N 1.353 1.506 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.6 -33.98 76.88 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.169 178.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.2 tp -62.04 -57.06 13.05 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.612 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.96 -29.07 25.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.128 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.24 -41.09 94.7 Favored Glycine 0 CA--C 1.541 1.695 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.54 -31.22 63.95 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 117.369 0.584 . . . . 0.0 111.223 179.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 -49.78 -35.24 21.86 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -178.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 6.9 tp -58.68 -40.92 80.84 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -175.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 16.4 m -55.91 -28.5 24.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 CA-C-N 119.305 0.957 . . . . 0.0 111.31 -178.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -55.63 -35.5 65.98 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.299 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.81 -39.02 70.76 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.015 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 75.2 t -68.05 -39.79 82.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.92 -28.8 66.57 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.512 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 23.4 p -59.92 -35.52 75.06 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.652 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.2 tp -59.11 -40.62 85.91 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 20.1 t -66.29 -19.8 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.594 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -60.76 -10.91 6.12 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 23.0 ptt85 -101.02 -12.76 18.62 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 55.9 t -82.86 -30.86 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.226 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 83.4 mtm-85 . . . . . 0 C--O 1.218 -0.572 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.27 -179.083 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 5.4 tp -67.11 -146.74 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -169.34 96.34 0.33 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.367 0.53 . . . . 0.0 110.919 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.9 tt -67.08 -40.43 87.01 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-O 120.929 0.395 . . . . 0.0 111.368 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -68.21 -23.5 64.83 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.248 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -67.26 -34.6 77.77 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.709 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -61.08 -35.74 77.79 Favored 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.512 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -92.37 -19.26 22.28 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.97 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 75.5 m -73.91 -37.34 64.68 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.044 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.48 -9.06 11.05 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.889 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -68.34 -19.73 64.67 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.219 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -84.67 -48.13 9.78 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 4.5 p90 -100.95 -22.74 14.7 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 118.082 0.401 . . . . 0.0 111.967 -178.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 48.58 16.64 0.11 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -63.4 -54.03 43.13 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.18 -177.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.77 -31.32 47.96 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 C-N-CA 119.699 -0.8 . . . . 0.0 110.704 178.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 13.8 m -58.26 -33.84 69.84 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.459 -178.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -59.69 -44.05 93.8 Favored 'General case' 0 C--O 1.215 -0.753 0 C-N-CA 119.817 -0.753 . . . . 0.0 108.973 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -72.82 -46.09 54.94 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.451 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 14.1 mt -67.57 -2.87 7.34 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.7 m95 -133.23 142.51 48.6 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 92.12 -32.51 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.232 1.013 . . . . 0.0 111.277 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.7 pp -68.09 -41.23 84.13 Favored 'Isoleucine or valine' 0 C--N 1.35 0.624 0 C-N-CA 119.315 -0.954 . . . . 0.0 109.55 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -69.28 -47.08 65.62 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.98 -37.43 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.734 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -52.19 -43.72 64.34 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.865 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.9 mp -58.73 -37.91 68.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.753 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 39.6 mm -58.04 -42.13 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 80.2 mt -59.86 -41.19 84.94 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 176.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 57.2 t -67.51 -25.41 33.15 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.593 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.76 -32.28 81.12 Favored Glycine 0 C--N 1.35 1.336 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.9 m -86.16 -31.82 21.59 Favored 'General case' 0 C--O 1.219 -0.529 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 5.2 tp -59.69 -44.63 93.58 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.009 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 4.1 tp -55.58 -35.85 39.88 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.988 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -72.61 -40.11 54.44 Favored Glycine 0 C--O 1.215 -1.078 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.8 -40.21 75.51 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 120.861 0.362 . . . . 0.0 110.886 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -53.31 -35.21 59.91 Favored 'General case' 0 C--O 1.214 -0.789 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.27 -40.69 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 120.451 -0.499 . . . . 0.0 112.008 -176.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 12.4 p -55.96 -28.26 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.021 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -55.41 -35.88 65.85 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.602 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.02 -35.71 67.15 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.435 -0.506 . . . . 0.0 109.763 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 92.6 t -65.77 -34.36 69.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 9.0 tp -60.28 -29.84 69.08 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.915 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 26.8 m -57.95 -45.52 86.51 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.657 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 15.0 tp -64.88 -39.99 94.42 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 78.0 t -69.73 -24.94 27.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.56 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -71.0 -31.38 67.89 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -23.11 58.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.843 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 33.9 m -99.36 25.97 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 C-N-CA 120.534 -0.467 . . . . 0.0 111.259 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -51.09 70.85 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.357 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.83 179.741 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 9.8 tp . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 60.3 mt 61.13 123.61 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.344 0.403 . . . . 0.0 111.091 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -158.32 176.94 11.82 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.99 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.74 -39.52 88.99 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.486 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.09 -28.23 64.18 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.693 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -69.95 -46.02 66.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.741 -179.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -70.14 -37.58 75.29 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.591 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.32 -41.96 80.07 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.0 p -54.48 -31.5 55.93 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.475 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 13.0 tp -61.84 -10.5 9.33 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.918 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 37.8 m0 -68.4 -25.51 65.08 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.885 -0.726 . . . . 0.0 111.112 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -62.98 -46.29 88.41 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -23.91 13.6 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 120.009 -0.676 . . . . 0.0 111.447 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 72.7 t80 45.56 10.47 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -64.13 -54.7 29.66 Favored 'General case' 0 C--N 1.354 0.782 0 CA-C-N 119.74 1.155 . . . . 0.0 113.356 -177.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 9.2 tp -69.98 -27.58 33.27 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.914 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.838 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 9.4 m -58.71 -45.9 88.52 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.898 -178.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -61.81 -47.19 86.24 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.264 -0.575 . . . . 0.0 111.557 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -72.21 -42.04 66.21 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 7.9 tp -74.25 -33.01 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -177.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -96.28 23.95 6.19 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.204 -0.599 . . . . 0.0 112.326 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -137.9 11.47 2.88 Favored 'General case' 0 C--O 1.218 -0.583 0 C-N-CA 120.396 -0.521 . . . . 0.0 111.549 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 16.8 pt -65.05 -43.3 95.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 87.9 mtm-85 -59.69 -46.18 89.85 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.105 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -68.33 -39.22 80.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.132 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -62.27 -51.16 68.82 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 2.6 mp -65.14 -39.82 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.491 -178.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 80.4 mt -58.75 -41.71 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.855 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 55.3 mt -58.54 -41.63 82.41 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 61.2 t -67.79 -29.4 44.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.878 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.92 -43.33 96.82 Favored Glycine 0 C--N 1.35 1.351 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -34.09 73.81 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 3.7 tp -63.53 -43.38 97.3 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.944 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -66.13 -39.1 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.822 -179.138 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.81 -42.09 87.28 Favored Glycine 0 CA--C 1.531 1.045 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.15 -31.44 63.35 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 120.743 0.306 . . . . 0.0 110.31 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -50.71 -31.9 17.88 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 122.814 0.446 . . . . 0.0 111.896 179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 45.5 mt -60.17 -42.87 91.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.356 -177.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 44.2 t -57.0 -28.94 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.517 -178.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -25.41 39.91 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.72 -35.52 22.29 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 33.8 m -59.82 -32.03 48.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 120.07 -0.652 . . . . 0.0 110.668 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 20.0 tp -60.26 -38.3 83.09 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.799 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 6.4 t -57.93 -38.87 76.7 Favored 'General case' 0 C--O 1.22 -0.479 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.975 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.9 tp -65.78 -42.8 90.36 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.072 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 39.8 t -71.25 -23.72 23.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.601 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.69 -14.82 62.03 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.16 -30.97 17.28 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.531 -179.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 34.8 m -88.39 -25.61 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.492 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -96.79 140.04 31.95 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.742 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.758 179.944 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 23.1 tp . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 tp -143.49 113.39 7.15 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -146.09 163.76 34.28 Favored 'General case' 0 C--O 1.218 -0.582 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.744 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 10.5 mt -61.42 -38.78 88.35 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.851 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.87 -28.62 62.61 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.534 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -70.23 -44.13 69.21 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.154 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -60.56 -57.05 14.37 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.368 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.57 -47.02 77.09 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.146 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 78.6 p -60.2 -31.94 70.63 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 123.224 0.328 . . . . 0.0 111.179 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 11.9 tp -64.19 -4.64 3.82 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -68.27 -6.59 24.65 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.818 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -63.17 -37.06 85.73 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -79.84 -22.68 42.69 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -176.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 64.23 -71.42 0.07 Allowed 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.198 1.363 . . . . 0.0 112.462 178.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -50.84 -49.69 58.32 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 46.1 mm -65.96 -40.53 87.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.666 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.2 m -58.93 -49.82 76.38 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.146 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -67.74 -40.53 84.15 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.516 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -60.53 -36.84 79.38 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.531 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 5.9 tp -76.9 -14.25 59.9 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 3.3 t90 -111.16 -19.12 12.82 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -95.0 -38.25 10.75 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.626 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 47.5 mm -57.57 -36.9 55.67 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.512 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.659 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.7 -33.91 66.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.06 178.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -68.0 -41.58 84.67 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -56.25 -28.05 57.17 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.883 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 36.8 mm -58.2 -45.44 88.84 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.577 -177.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 41.1 mt -65.42 -40.79 89.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 21.2 mm -55.95 -41.13 66.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.496 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.734 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 61.3 t -67.12 -23.66 30.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 120.033 -0.667 . . . . 0.0 111.942 -178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.63 -51.35 59.55 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-N 119.189 0.904 . . . . 0.0 111.555 179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 2.0 m -72.72 -21.89 60.97 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 117.247 0.523 . . . . 0.0 112.181 -179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.7 tp -55.95 -38.27 70.11 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.888 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -23.03 18.89 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.579 -179.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.48 -47.43 89.91 Favored Glycine 0 CA--C 1.542 1.76 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.102 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.54 -30.69 63.37 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -49.65 -34.92 19.69 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -177.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 7.2 tp -58.17 -40.27 76.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -175.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.6 p -55.72 -28.55 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 CA-C-N 118.968 0.804 . . . . 0.0 111.449 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -55.65 -35.32 65.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.37 -35.97 65.85 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.318 -177.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 77.5 t -64.73 -31.66 54.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 120.181 -0.608 . . . . 0.0 109.77 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.9 tp -58.83 -40.76 85.13 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.77 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 95.1 p -62.32 -33.92 75.61 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.141 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 19.5 tp -60.39 -42.9 96.86 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.13 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 27.2 m -83.2 -11.53 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.735 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -67.38 -21.05 65.63 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.45 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -73.53 -39.64 64.62 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.498 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 46.4 t -89.4 -35.94 8.16 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.236 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 . . . . . 0 C--O 1.219 -0.518 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.308 -179.944 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . 0.444 ' O ' ' O ' ' A' ' 661' ' ' LEU . 3.0 mp . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . 0.444 ' O ' ' O ' ' A' ' 660' ' ' LEU . 3.9 pp 39.75 -176.16 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 172.73 -179.07 0.07 Allowed 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.128 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -40.59 84.84 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-O 120.791 0.329 . . . . 0.0 110.244 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -73.94 -23.97 59.59 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.851 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -67.06 -45.45 77.33 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.293 -179.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -64.47 -38.61 91.64 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.978 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.8 -47.18 48.66 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.508 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 89.9 p -59.58 -31.64 69.63 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.038 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 56.6 tp -56.47 -26.78 55.15 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.062 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -68.54 -9.95 52.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 119.512 -0.875 . . . . 0.0 111.997 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -62.76 -48.85 77.37 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.583 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.68 -22.57 13.55 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.347 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 48.2 p90 41.39 22.05 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -63.89 -52.8 58.28 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.782 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . 0.405 HD12 HG22 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -68.67 -33.22 58.49 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.748 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.581 -179.202 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 51.7 p -58.44 -37.78 76.13 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.619 -178.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -60.57 -41.64 95.03 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.344 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 7.0 t90 -72.81 -46.42 53.22 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.54 -33.46 15.15 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.593 0.961 . . . . 0.0 113.593 -176.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.15 -11.02 60.38 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.287 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -110.16 -30.1 7.89 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 121.093 -0.243 . . . . 0.0 110.603 179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 1.2 mm -60.0 -43.83 93.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 45.9 ttp180 -62.2 -48.45 79.95 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.244 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 80.0 mt -64.12 -44.06 97.55 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.454 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -52.65 -27.83 18.93 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.2 mp -57.54 -48.38 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.218 -177.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 49.1 mt -58.59 -41.92 83.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.321 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 69.1 mt -60.19 -45.18 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.9 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 13.4 m -68.81 2.0 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 119.811 -0.755 . . . . 0.0 112.27 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -85.6 -64.2 1.51 Allowed Glycine 0 C--N 1.347 1.173 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 29.8 m -52.1 -25.16 8.12 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.611 -0.435 . . . . 0.0 110.683 178.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -54.03 -32.58 54.79 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.785 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -35.39 73.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.156 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.919 -178.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.02 -56.28 5.87 Favored Glycine 0 CA--C 1.537 1.43 0 C-N-CA 120.007 -1.092 . . . . 0.0 113.767 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -31.6 70.48 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.992 1.396 . . . . 0.0 110.456 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 20.1 tpp180 -50.74 -35.88 33.68 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-O 120.723 0.297 . . . . 0.0 110.348 177.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 58.1 mt -59.21 -40.35 80.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.782 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 3.5 p -55.55 -28.06 22.27 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.807 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.347 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -55.04 -35.4 64.42 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.929 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.78 -35.59 66.43 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.911 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 1.7 p -59.88 -34.2 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.075 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.05 -24.84 67.86 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.284 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 32.1 m -57.87 -44.75 86.83 Favored 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.778 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.54 -40.39 92.84 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 61.6 t -60.61 -28.33 42.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.342 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -63.33 -7.33 6.13 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 11.2 ttp85 -73.6 -44.82 56.18 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.485 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 43.0 t -89.42 -36.03 8.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.219 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 38.23 46.99 0.94 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 58.3 tp60 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.017 -0.992 . . . . 0.0 111.037 179.753 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 55.8 mt . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -146.84 135.36 21.97 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.287 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -168.75 137.99 2.23 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.01 -18.25 4.89 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.356 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -72.48 -31.46 65.4 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 121.058 -0.257 . . . . 0.0 110.753 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -69.43 -44.91 70.36 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.369 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 85.4 m95 -66.23 -38.84 88.88 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.355 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.4 -35.83 71.17 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.144 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 2.9 t -54.98 -31.44 60.86 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.075 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.9 -14.8 50.95 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.934 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -68.79 -28.27 66.62 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.962 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -62.83 -47.93 81.26 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.508 -0.477 . . . . 0.0 112.197 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.44 -22.46 13.65 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.717 -178.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 53.45 7.83 0.11 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -63.45 -53.22 55.63 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.291 0.95 . . . . 0.0 112.276 -178.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 8.8 tp -68.97 -32.8 55.98 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.75 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.632 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -59.02 -46.77 87.36 Favored 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.441 -178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -64.68 -46.67 81.45 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.823 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.4 t90 -65.18 -38.19 89.74 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.088 -179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.42 -19.34 28.2 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -100.61 9.68 42.17 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.619 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -129.99 -1.24 4.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.525 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 12.7 tt -68.46 -44.18 83.4 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 17.1 ttm105 -55.81 -47.89 76.37 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.498 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.2 mp -64.54 -36.92 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.773 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -52.01 -39.09 58.94 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 119.101 -0.476 . . . . 0.0 112.26 -178.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.27 -38.55 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 119.79 -0.764 . . . . 0.0 109.956 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.77 -41.91 83.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 3.8 mp -66.69 -42.19 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 66.1 t -68.52 -1.78 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.202 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.151 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -91.75 -45.57 3.92 Favored Glycine 0 C--N 1.35 1.343 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 27.3 m -53.52 -30.13 39.96 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.121 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 8.4 mp -61.71 -36.3 80.52 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.034 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . 0.404 HG23 HD12 ' B' ' 693' ' ' ILE . 0.3 OUTLIER -59.27 -33.37 50.66 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 120.164 -0.614 . . . . 0.0 110.756 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -70.03 -36.46 72.63 Favored Glycine 0 CA--C 1.534 1.241 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 179.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.14 -31.6 63.49 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.426 -178.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.16 -31.56 13.89 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 48.7 mm -59.91 -48.29 88.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.427 -177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 16.1 m -66.75 -28.36 42.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.752 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -55.49 -26.82 44.77 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.623 -179.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.6 -40.68 79.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.459 -0.496 . . . . 0.0 109.875 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 63.0 t -64.49 -42.62 95.76 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.11 -38.64 89.66 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.472 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 68.1 m -57.91 -34.54 69.95 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.963 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.8 tp -66.1 -42.1 89.7 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.995 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.69 -17.43 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.915 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -60.96 -26.2 67.37 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.465 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -73.79 -36.45 65.04 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.851 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 43.0 t -82.91 -36.13 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.273 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 66.3 mtm180 -144.01 130.92 20.39 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.709 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 C--O 1.22 -0.479 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.648 -179.97 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 3.1 tt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 28.3 mt -136.27 132.04 35.22 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -170.6 -176.51 2.12 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.099 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.45 -31.39 34.47 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.371 -179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -71.21 -40.35 71.2 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.707 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.7 mmtt -70.22 -43.51 70.5 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.169 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -60.24 -44.67 95.03 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.96 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.63 -41.04 88.93 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.534 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 20.1 m -56.58 -31.94 64.73 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.269 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 9.2 tp -70.48 -4.72 24.15 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -72.71 -13.77 61.41 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -178.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -62.77 -50.42 71.12 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 118.291 -1.364 . . . . 0.0 110.593 -178.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . 0.415 ' O ' ' N ' ' C' ' 674' ' ' ASP . 0.3 OUTLIER -101.75 -23.35 14.22 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 178.881 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 49.0 p90 42.01 9.19 0.0 OUTLIER 'General case' 0 C--N 1.362 1.128 0 N-CA-C 116.408 2.003 . . . . 0.0 116.408 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' C' ' 672' ' ' TRP . 30.2 t70 -64.22 -53.97 40.9 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 120.156 1.344 . . . . 0.0 110.662 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 9.3 tp -69.88 -29.67 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.454 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 17.3 m -58.45 -40.02 81.5 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.504 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.43 -46.31 90.5 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 119.964 -0.694 . . . . 0.0 109.564 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -56.84 -39.09 73.6 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.259 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.01 -2.87 42.31 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -179.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 4.7 t90 -146.83 44.06 1.17 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 119.772 -0.771 . . . . 0.0 112.325 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -161.18 -42.32 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . 0.443 HD11 HG23 ' C' ' 682' ' ' ILE . 0.1 OUTLIER -55.88 -36.91 45.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.49 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 3.5 ptt-85 -55.81 -40.73 73.16 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 40.5 mm -59.85 -41.3 85.3 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -67.09 -27.77 67.63 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.807 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.1 tp -57.89 -43.6 84.83 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.727 -177.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 39.2 mt -59.27 -41.64 84.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.027 -179.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 3.4 mp -56.82 -41.5 75.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 52.4 t -67.67 -31.38 52.2 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.126 0 CA-C-O 118.684 -0.674 . . . . 0.0 112.197 -177.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -62.74 -53.48 40.83 Favored Glycine 0 CA--C 1.538 1.491 0 CA-C-N 119.415 1.007 . . . . 0.0 111.632 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.5 m -61.83 -24.39 66.86 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 117.231 0.515 . . . . 0.0 112.377 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.5 tp -54.22 -32.63 56.36 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.711 -178.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.3 pp -70.19 -28.07 34.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 120.259 -0.576 . . . . 0.0 111.134 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.71 -55.27 23.57 Favored Glycine 0 CA--C 1.542 1.778 0 C-N-CA 121.182 -0.532 . . . . 0.0 113.125 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.3 tt -58.42 -36.45 73.63 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.56 -35.85 31.78 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.18 -41.02 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.18 -178.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 64.9 t -56.49 -29.0 27.91 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.827 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -56.05 -35.25 66.7 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.35 -34.93 64.69 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.103 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 9.3 p -59.06 -31.53 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.5 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.59 -30.54 67.27 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.391 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.3 t -57.93 -39.0 76.95 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.849 -0.341 . . . . 0.0 110.428 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 16.3 tp -56.51 -31.21 63.87 Favored 'General case' 0 C--O 1.218 -0.588 0 C-N-CA 120.635 -0.426 . . . . 0.0 109.871 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.8 t -75.66 -17.57 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.042 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -60.66 -22.36 63.77 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.18 -3.7 58.9 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 120.625 -0.43 . . . . 0.0 112.018 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 48.3 t -104.41 -36.03 3.77 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.534 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.319 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 . . . . . 0 C--O 1.217 -0.652 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.959 -179.871 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 pt? . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 9.5 mp -99.72 155.38 17.66 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.252 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -163.51 159.78 22.42 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.758 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 8.9 tt -61.83 -40.53 95.61 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.775 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -72.68 -23.91 60.94 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.478 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -64.41 -40.0 94.93 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.914 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -70.25 -49.61 48.14 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.148 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.81 -31.38 72.32 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.48 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 1.8 m -57.43 -31.59 66.05 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.112 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 70.4 mt -71.27 -4.83 27.97 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -68.98 -1.0 6.37 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -62.32 -49.17 76.69 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 118.41 -1.316 . . . . 0.0 111.887 -176.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -104.23 -11.04 17.46 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.832 177.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.3 p90 43.33 18.84 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -64.42 -52.93 55.61 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.507 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.1 tp -68.84 -28.35 39.41 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.316 -179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 75.7 p -58.9 -40.35 84.2 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 119.818 -0.753 . . . . 0.0 109.386 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -65.33 -33.83 76.9 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.807 178.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 42.3 t90 -69.83 -44.56 69.72 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.868 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.68 -2.6 7.17 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.222 -178.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -136.48 -58.43 0.74 Allowed 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 119.723 -0.791 . . . . 0.0 112.874 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -72.52 -41.44 65.88 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 120.482 -0.487 . . . . 0.0 112.258 -177.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 28.9 mm -67.26 -36.44 76.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -55.29 -48.03 74.68 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.185 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.91 -43.14 91.52 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 C-N-CA 120.991 -0.283 . . . . 0.0 111.178 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -52.57 -28.71 22.1 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -177.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.95 -37.83 63.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 CA-C-O 119.188 -0.434 . . . . 0.0 111.18 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.11 -41.95 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.077 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 5.1 mp -64.56 -40.97 90.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 21.9 t -68.32 4.38 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -110.71 -5.77 27.29 Favored Glycine 0 CA--C 1.543 1.828 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 178.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 54.2 m -88.24 -32.84 18.33 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 117.141 0.471 . . . . 0.0 111.343 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.67 -32.6 52.29 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.089 -178.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -54.82 -34.18 29.98 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 120.3 -0.56 . . . . 0.0 109.898 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.42 -43.82 36.22 Favored Glycine 0 C--N 1.346 1.117 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 177.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.43 -37.43 70.2 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.151 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -50.68 -35.37 30.58 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 122.776 0.431 . . . . 0.0 111.152 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 75.2 mt -59.31 -41.97 85.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 CA-C-O 118.994 -0.527 . . . . 0.0 111.214 -176.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 2.4 p -67.6 -28.49 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 118.956 0.798 . . . . 0.0 111.074 179.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -55.06 -35.01 64.06 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.461 0.172 . . . . 0.0 110.642 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.42 -35.49 65.44 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.895 -178.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.59 -38.23 77.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.758 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.62 -29.07 69.81 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.755 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 4.0 t -63.62 -31.91 73.22 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.101 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 30.6 tp -62.73 -39.52 94.35 Favored 'General case' 0 C--O 1.218 -0.588 0 O-C-N 123.102 0.251 . . . . 0.0 111.085 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 35.1 m -82.65 -10.8 12.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -63.81 -24.06 67.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 120.725 -0.39 . . . . 0.0 112.027 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 12.6 ptt-85 -76.6 -19.13 58.18 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 120.378 -0.529 . . . . 0.0 112.305 -179.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 6.7 m -104.99 26.05 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 55.2 mtm180 -86.53 152.95 22.2 Favored 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.572 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.068 -0.967 . . . . 0.0 110.917 -179.908 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 3.6 pp . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 70.2 mt -124.65 154.61 40.48 Favored 'General case' 0 C--O 1.22 -0.479 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.101 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -147.83 145.87 28.89 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.783 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 4.6 tt -54.95 -40.01 69.52 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 121.016 0.436 . . . . 0.0 110.325 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.57 -35.46 77.43 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.701 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -68.14 -43.04 79.21 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.45 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -59.75 -48.71 80.59 Favored 'General case' 0 C--O 1.22 -0.449 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.374 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -54.23 -33.03 57.47 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.757 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.51 -32.97 69.32 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.098 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 49.0 tp -59.53 -17.34 31.43 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.712 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -68.64 -17.07 64.03 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -89.46 -16.65 30.34 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -86.49 -22.66 26.3 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.32 -177.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 41.0 t80 59.87 -73.06 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -51.44 -53.01 41.37 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -176.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 5.0 tp -68.27 -27.93 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 119.829 -0.749 . . . . 0.0 110.777 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.3 m -63.25 -48.28 78.88 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.589 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -71.24 -41.36 70.23 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.785 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.5 t90 -62.81 -44.22 96.74 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.331 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.78 -27.51 58.04 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.557 -178.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.6 t90 -91.89 0.02 57.49 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -119.0 -6.28 10.5 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.626 -0.43 . . . . 0.0 112.092 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 7.8 pt -63.44 -42.65 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.669 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -43.95 77.01 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.769 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 56.8 mt -66.65 -37.74 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 178.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -55.8 -29.97 60.59 Favored 'General case' 0 C--O 1.218 -0.601 0 C-N-CA 121.112 -0.235 . . . . 0.0 111.47 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 27.2 mm -60.02 -41.84 87.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.45 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.82 -41.82 83.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 2.8 mp -61.93 -42.33 94.31 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 60.0 t -68.64 -2.14 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.237 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -86.33 -55.83 2.4 Favored Glycine 0 C--N 1.351 1.368 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 21.9 m -58.08 -30.79 66.5 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.741 179.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.3 tp -54.71 -34.35 62.26 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.772 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.91 -27.76 23.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 120.349 -0.541 . . . . 0.0 111.321 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.86 -41.65 87.85 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.53 -31.79 64.48 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 121.249 -0.18 . . . . 0.0 111.021 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.98 -30.94 16.39 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 58.9 mt -59.44 -41.53 84.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.085 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 47.4 t -65.28 -28.59 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.496 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.47 -26.66 43.69 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.035 -179.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -51.37 -37.04 46.01 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.735 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.27 -42.42 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.547 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.53 -29.09 69.78 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.035 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 20.9 t -57.98 -32.35 67.79 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.609 -0.437 . . . . 0.0 111.279 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 26.1 tp -66.08 -40.94 91.22 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.241 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -64.63 -25.62 38.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.788 0 C-N-CA 120.726 -0.389 . . . . 0.0 110.17 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -67.27 -13.07 61.64 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.433 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.26 -31.74 13.33 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 120.396 0.141 . . . . 0.0 110.671 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 20.4 t -87.79 25.96 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.398 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -50.61 117.89 2.73 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 122.148 -0.345 . . . . 0.0 111.29 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.369 -179.998 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 4.2 pp -162.58 151.25 14.75 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 120.807 0.337 . . . . 0.0 111.219 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -171.26 179.25 3.04 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.903 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.11 -30.99 71.4 Favored 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.449 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.49 -36.44 78.93 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.651 -0.419 . . . . 0.0 110.845 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 59.1 mmtt -70.43 -42.37 71.66 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.369 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -70.4 -53.99 14.25 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.62 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.58 -37.51 75.93 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.4 t -62.83 -33.46 75.28 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.844 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 19.9 tp -70.99 -5.28 29.95 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -68.58 -6.11 23.68 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -79.9 -49.64 11.62 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 119.567 -0.853 . . . . 0.0 113.269 -178.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -89.94 -23.77 21.48 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 114.738 1.384 . . . . 0.0 114.738 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 55.17 -10.26 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 178.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -63.9 -54.53 33.28 Favored 'General case' 0 C--N 1.352 0.715 0 CA-C-N 120.465 1.484 . . . . 0.0 112.381 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 7.9 tp -70.14 -32.81 52.31 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.962 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -58.77 -39.07 79.93 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.916 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -59.73 -47.51 85.36 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 120.365 -0.534 . . . . 0.0 109.692 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 19.5 t90 -72.61 -28.27 62.67 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.132 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.45 -4.05 10.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.521 -179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -142.48 -179.09 6.09 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 64.58 -11.3 0.13 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.01 -37.07 59.18 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 CA-C-N 119.444 1.02 . . . . 0.0 110.5 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 41.0 mtt85 -60.71 -48.3 82.41 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.886 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.7 -44.07 99.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.725 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.76 -28.53 69.94 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.484 0.49 . . . . 0.0 110.154 178.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.64 -38.77 73.34 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.832 -178.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 45.7 mt -67.11 -42.92 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.268 -178.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 4.0 mp -57.97 -41.06 79.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-O 119.477 -0.297 . . . . 0.0 111.772 -178.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 38.3 t -67.56 -20.06 25.91 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -176.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -90.77 14.38 63.28 Favored Glycine 0 CA--C 1.545 1.942 0 CA-C-N 119.994 1.27 . . . . 0.0 113.409 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.6 m -88.68 -34.25 17.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.365 1.083 . . . . 0.0 112.418 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.16 -33.09 72.86 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.982 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.1 pp -57.81 -40.05 74.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 119.794 -0.762 . . . . 0.0 110.267 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.9 -53.36 46.98 Favored Glycine 0 CA--C 1.539 1.593 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 7.7 tt -56.63 -31.6 64.49 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 -50.55 -36.52 34.83 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 -178.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.67 -41.64 85.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.582 -177.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.6 -28.87 45.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.64 -35.16 73.84 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.667 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.3 -35.41 65.06 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.148 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 80.4 t -59.54 -31.41 46.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.029 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.4 tp -58.34 -34.29 70.47 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.418 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 29.2 p -58.0 -37.61 74.6 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.561 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.8 tp -57.59 -39.9 77.84 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.671 -0.411 . . . . 0.0 109.946 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 28.9 t -72.82 -31.43 36.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.702 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -60.92 -8.82 3.43 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -109.65 -32.84 6.96 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 39.8 t -82.94 -29.13 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.835 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 . . . . . 0 C--O 1.219 -0.512 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.042 -179.854 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 44.4 mt 60.23 115.31 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.144 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -165.65 168.5 16.21 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.208 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.3 tt -52.52 -38.82 60.47 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.823 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.15 -34.62 68.65 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.518 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -68.18 -44.32 76.16 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.356 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -58.7 -44.1 90.24 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-O 120.815 0.34 . . . . 0.0 110.942 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -51.68 -19.66 1.69 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.142 -178.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 32.1 t -64.69 -32.65 74.42 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.421 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.82 -20.49 63.44 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -68.89 -17.22 63.94 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.905 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -63.24 -35.49 80.52 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 3.9 m95 -94.84 -23.44 17.48 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 119.76 -0.776 . . . . 0.0 111.099 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 18.5 t80 66.8 -41.74 0.4 Allowed 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 178.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -52.09 64.32 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -177.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 8.1 tp -62.92 -29.91 48.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.719 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.177 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.4 m -59.69 -37.57 79.16 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.835 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -66.27 -23.16 66.35 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.503 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -72.05 -46.4 57.14 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.225 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.11 -24.45 19.12 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -177.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -74.07 -0.59 16.96 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 119.397 -0.921 . . . . 0.0 111.607 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -128.31 -25.07 3.01 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.617 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.4 tt -55.56 -36.6 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.874 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 26.9 ttp-105 -55.84 -48.42 75.52 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 29.3 mt -64.89 -45.97 93.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -52.83 -33.22 48.39 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.9 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.4 -42.81 85.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 3.7 mm -58.44 -42.14 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 119.907 -0.717 . . . . 0.0 109.564 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 41.8 mm -57.08 -41.01 76.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-N 116.965 -0.107 . . . . 0.0 110.958 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 42.8 t -67.75 -0.09 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 C-N-CA 120.158 -0.617 . . . . 0.0 111.495 -178.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.97 -40.23 8.18 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 177.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 4.3 m -77.86 -16.92 57.91 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.461 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.5 tp -58.83 -44.04 90.8 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.171 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -30.48 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.231 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.55 -37.82 78.34 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.335 -1.506 . . . . 0.0 109.335 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.57 -35.97 68.78 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 120.572 0.225 . . . . 0.0 110.752 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.55 -33.89 23.48 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 123.249 0.62 . . . . 0.0 111.479 178.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 77.3 mt -57.8 -40.08 74.13 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.457 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 16.8 m -55.62 -28.21 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 119.227 0.921 . . . . 0.0 110.77 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . 0.409 ' HA ' ' HB3' ' A' ' 702' ' ' LEU . 28.9 m-85 -55.45 -36.43 66.53 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.58 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.77 -48.02 78.83 Favored 'General case' 0 C--O 1.219 -0.553 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.92 -43.78 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . 0.409 ' HB3' ' HA ' ' A' ' 699' ' ' PHE . 0.6 OUTLIER -58.88 -24.81 62.72 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.729 178.629 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.7 -43.16 94.22 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.376 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.0 tp -65.27 -36.71 84.93 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-O 121.085 0.469 . . . . 0.0 110.062 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.61 -36.1 68.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.052 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.88 -8.74 3.34 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.888 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.95 -45.64 49.03 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 120.594 0.235 . . . . 0.0 111.038 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 6.9 t -98.78 26.49 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.563 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -36.16 146.26 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 . . . . . 0 C--O 1.219 -0.528 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.164 -179.245 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 39.6 mt . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 49.47 -152.04 0.15 Allowed 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -170.49 65.7 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.32 0.509 . . . . 0.0 111.272 -178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 5.8 tt -66.88 -41.11 87.76 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 119.981 -0.688 . . . . 0.0 111.974 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -74.58 -29.28 61.27 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.092 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -70.46 -25.46 63.19 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 118.889 -0.577 . . . . 0.0 111.917 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -58.91 -50.7 73.05 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 119.051 -1.059 . . . . 0.0 108.435 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.65 -41.89 95.8 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.996 -178.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 37.9 m -65.85 -31.74 72.87 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.52 -0.472 . . . . 0.0 109.911 178.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 29.8 mt -72.46 -4.98 33.61 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.155 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -68.41 -3.0 9.74 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.574 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 29.6 m-20 -89.38 -12.71 39.6 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -178.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -88.92 -22.75 22.95 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.716 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 60.0 -72.38 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -51.74 -52.31 49.63 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -31.12 50.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 119.571 -0.852 . . . . 0.0 110.569 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.9 m -58.74 -43.21 90.17 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.96 -37.83 83.77 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.108 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -71.63 -42.08 68.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.045 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.13 -6.57 18.2 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 119.367 -0.933 . . . . 0.0 111.114 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -129.61 176.4 8.02 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 72.36 -19.48 0.29 Allowed 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 27.2 pt -55.76 -37.05 45.37 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 CA-C-N 118.169 0.44 . . . . 0.0 110.453 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -45.65 91.26 Favored 'General case' 0 C--O 1.219 -0.541 0 O-C-N 123.102 0.251 . . . . 0.0 110.408 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 38.1 mt -67.15 -38.08 80.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.43 -28.87 60.73 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.514 -178.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 22.4 mm -63.8 -41.06 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.842 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 3.6 mp -58.82 -42.16 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 4.0 mp -62.82 -43.11 98.59 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.55 -1.93 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.181 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.099 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -89.79 -61.47 1.36 Allowed Glycine 0 C--N 1.349 1.296 0 N-CA-C 110.619 -0.993 . . . . 0.0 110.619 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 2.9 m -53.22 -20.81 4.43 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.127 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.21 -32.58 62.37 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 121.247 -0.181 . . . . 0.0 110.841 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.5 -38.3 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.075 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -65.58 -45.07 91.45 Favored Glycine 0 C--O 1.213 -1.195 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.706 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.87 -39.35 74.17 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -50.55 -31.41 15.61 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 7.9 tp -59.69 -41.58 85.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 C-N-CA 119.776 -0.77 . . . . 0.0 111.619 -177.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 84.1 t -58.99 -28.31 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 121.289 -0.164 . . . . 0.0 111.019 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -24.87 36.62 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.22 -35.08 16.42 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 119.173 -0.441 . . . . 0.0 112.154 -177.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 34.8 m -59.24 -36.04 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.029 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.9 tt -68.52 -40.18 80.88 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 31.1 p -59.73 -31.94 70.08 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.711 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -25.59 67.01 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 120.662 -0.415 . . . . 0.0 109.973 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 59.1 t -90.22 -10.75 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.952 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -65.32 -10.74 35.24 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -73.98 -39.23 63.82 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 119.817 -0.753 . . . . 0.0 110.82 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 29.9 t -91.3 -4.42 10.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.342 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 75.8 ttt-85 -57.47 132.97 54.75 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.46 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.888 -179.964 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 119.444 -0.313 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.84 -84.84 0.02 OUTLIER 'General case' 0 C--N 1.348 0.543 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.54 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -175.68 72.45 0.02 OUTLIER 'General case' 0 C--N 1.354 0.773 0 CA-C-N 118.805 0.729 . . . . 0.0 112.283 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.29 -40.07 93.35 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.057 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -74.37 -29.74 61.68 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -70.57 -29.36 65.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.452 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 37.5 m95 -58.52 -49.61 76.75 Favored 'General case' 0 C--O 1.22 -0.447 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.39 90.86 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.527 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 6.0 m -62.34 -31.02 71.6 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.661 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 9.7 tp -55.36 -16.64 3.74 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.379 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 26.2 m95 -68.66 -15.44 63.52 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.291 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -62.59 -42.75 99.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.149 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.4 m95 -79.93 -22.38 42.77 Favored 'General case' 0 CA--C 1.552 1.048 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 15.5 t80 70.22 -51.94 0.65 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.982 1.265 . . . . 0.0 112.711 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -52.44 63.0 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -68.44 -30.97 49.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.393 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 94.4 m -63.41 -50.28 70.43 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.844 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -68.6 -44.16 74.9 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 123.354 0.409 . . . . 0.0 110.951 -179.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -61.39 -43.56 98.66 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.937 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.92 -33.18 45.72 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.215 -179.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 21.9 t90 -59.61 -37.43 78.57 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.97 -178.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 2.3 p90 -123.93 29.93 6.32 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 119.973 -0.691 . . . . 0.0 112.334 -178.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 7.1 tp -55.77 -37.03 45.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.66 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.859 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.0 -34.66 78.5 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.239 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 95.0 mt -62.5 -46.22 96.92 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.556 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -57.99 -29.54 65.34 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.381 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 21.8 mm -64.01 -44.1 97.76 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.985 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.9 mt -58.96 -41.41 83.03 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 73.9 mt -56.58 -41.53 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 58.7 t -67.63 -31.5 52.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.042 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.19 -38.67 87.47 Favored Glycine 0 C--N 1.353 1.518 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 178.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 10.7 m -78.28 -24.33 46.83 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 117.139 0.47 . . . . 0.0 111.183 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.48 -43.58 96.87 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.217 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -61.96 -38.21 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.156 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.73 -36.4 89.63 Favored Glycine 0 CA--C 1.544 1.884 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.315 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.99 -31.16 62.78 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 117.049 0.425 . . . . 0.0 111.87 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -49.98 -34.76 22.01 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 9.0 tp -58.24 -40.88 79.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.2 p -56.12 -28.93 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 119.551 1.068 . . . . 0.0 110.992 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.58 -35.08 79.77 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.634 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.09 -35.78 64.96 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.522 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 69.9 t -60.0 -31.95 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.118 178.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.87 -30.69 67.93 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.867 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 15.4 m -58.24 -40.49 81.9 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.246 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 16.3 tp -55.95 -26.8 49.63 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.622 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 20.4 t -81.59 -24.65 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.372 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -60.57 -20.83 61.63 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.05 -42.66 59.88 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 120.742 0.305 . . . . 0.0 110.558 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 20.4 t -97.32 2.23 10.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.372 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? . . . . . 0 C--O 1.219 -0.529 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.628 179.999 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 2.2 mm? . . . . . 0 N--CA 1.489 1.506 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 7.2 tt 55.4 104.23 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.954 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -139.97 161.38 37.74 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.39 179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -37.76 86.68 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.128 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -74.84 -26.47 59.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.595 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.07 -46.07 85.94 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -65.17 -48.27 74.08 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.052 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.32 -28.67 59.65 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.756 -179.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.3 t -62.15 -31.91 72.45 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.165 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.9 mp -72.28 -14.26 61.71 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -68.61 -25.07 64.67 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.608 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 37.9 t-20 -62.55 -36.42 82.58 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.5 m95 -83.36 -22.89 32.69 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.334 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 67.89 -40.13 0.41 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -62.04 -52.34 64.32 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.1 tp -68.16 -38.47 79.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 119.872 -0.731 . . . . 0.0 111.048 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -61.87 -44.43 96.84 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 119.933 -0.707 . . . . 0.0 109.579 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -65.52 -37.68 87.45 Favored 'General case' 0 C--O 1.214 -0.787 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.207 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 7.5 t90 -70.72 -34.5 71.98 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.64 -3.42 8.96 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 120.468 -0.493 . . . . 0.0 111.456 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.98 150.69 49.35 Favored 'General case' 0 C--O 1.211 -0.966 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 84.08 -23.0 0.19 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.453 0.701 . . . . 0.0 110.473 -178.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 1.4 tp -67.62 -42.93 87.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 21.2 ttp-105 -60.59 -48.07 83.38 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.83 -38.03 74.36 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.13 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -52.7 -43.28 65.51 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.527 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.8 mp -58.29 -37.89 65.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.9 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 81.2 mt -58.17 -43.8 86.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 61.2 mt -58.32 -41.43 81.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 177.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 43.5 t -67.74 -3.09 2.06 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.348 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -86.29 -53.83 2.86 Favored Glycine 0 C--N 1.349 1.277 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 178.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 15.9 m -61.36 -20.62 63.21 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.735 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.7 tp -54.04 -46.91 72.03 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.593 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 2.1 pp -55.97 -41.21 66.89 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.867 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.84 -51.62 52.11 Favored Glycine 0 C--O 1.214 -1.098 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.08 -34.23 73.16 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.993 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -65.35 -36.41 83.94 Favored 'General case' 0 C--O 1.214 -0.786 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -178.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 4.9 pt -58.98 -40.41 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 CA-C-N 119.708 1.14 . . . . 0.0 112.352 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 5.2 p -55.59 -26.79 20.32 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.915 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.33 -178.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -54.27 -33.88 59.62 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.28 -35.53 62.67 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 119.042 -0.504 . . . . 0.0 111.968 -176.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 32.9 m -61.09 -31.92 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.481 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -24.39 63.93 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.551 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 33.9 m -57.45 -43.11 83.66 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.919 -178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.2 tp -70.24 -36.45 74.49 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.122 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 56.9 t -60.68 -35.7 65.74 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.568 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -60.94 -21.29 63.28 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.662 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 45.1 mtp85 -101.92 -22.5 14.31 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.435 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 17.0 t -108.67 26.15 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.552 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.42 -23.85 52.01 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.474 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.706 -179.917 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.234 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 65.6 mt -137.47 124.3 21.25 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.498 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -151.26 176.51 11.15 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.581 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.19 -18.19 1.4 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.945 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.51 -47.97 29.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.243 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -70.24 -38.59 75.21 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.101 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 71.8 m95 -64.96 -37.12 86.61 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.015 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.86 -46.0 88.81 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.171 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 1.9 t -59.76 -31.75 69.94 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.068 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.37 -26.36 52.67 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.174 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.77 -2.86 10.35 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 119.592 -0.843 . . . . 0.0 112.007 -179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -75.71 -19.09 59.34 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.619 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 5.5 m95 -102.98 -23.2 13.72 Favored 'General case' 0 C--O 1.211 -0.935 0 C-N-CA 120.166 -0.614 . . . . 0.0 111.557 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 64.07 -59.13 0.2 Allowed 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -51.0 -52.39 43.37 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.21 -35.52 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 120.308 -0.557 . . . . 0.0 111.237 -179.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 15.2 m -62.3 -44.75 95.79 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.319 -0.552 . . . . 0.0 110.689 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -66.3 -46.94 75.22 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -64.47 -38.68 91.87 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.534 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 8.3 tp -74.27 -20.19 60.23 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -109.4 9.22 25.62 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 120.573 -0.451 . . . . 0.0 112.006 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -123.53 0.5 8.81 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.065 178.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 11.3 tt -68.24 -37.78 78.57 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 CA-C-N 116.819 -0.173 . . . . 0.0 111.31 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -56.16 -46.62 79.23 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.489 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 78.2 mt -68.07 -38.12 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.332 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -64.78 -40.63 95.58 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.971 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 48.2 mt -61.84 -42.29 94.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.934 -179.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.6 mt -59.49 -41.76 85.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.479 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 79.0 mt -56.69 -41.24 74.01 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 28.1 t -67.35 -28.81 43.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 120.222 -0.591 . . . . 0.0 111.706 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.38 -26.32 43.96 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 119.946 -1.121 . . . . 0.0 110.832 178.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 16.7 m -88.1 -30.21 20.03 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 116.783 0.292 . . . . 0.0 111.351 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.72 -32.56 52.45 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 120.635 0.255 . . . . 0.0 110.618 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -76.0 -27.73 18.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.892 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.76 -55.71 20.89 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 119.383 -1.389 . . . . 0.0 113.743 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -29.89 70.95 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 118.138 0.969 . . . . 0.0 113.314 -178.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 14.4 mmt180 -49.38 -30.4 7.74 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 43.3 pt -58.35 -38.77 71.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 118.102 0.41 . . . . 0.0 110.796 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 3.9 p -54.53 -27.46 17.72 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.37 -177.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -54.9 -26.65 37.27 Favored 'General case' 0 C--O 1.214 -0.77 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.796 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -52.67 -35.64 55.55 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 53.3 t -59.65 -31.34 46.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.54 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 34.1 tp -58.22 -33.89 69.82 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.505 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 7.9 m -58.24 -31.8 67.73 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 6.4 mp -77.63 -43.15 32.38 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 33.5 m -93.0 -10.66 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -178.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -60.74 -34.11 73.93 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.439 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.23 -0.73 52.77 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 61.3 t -84.1 -36.05 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 120.594 -0.443 . . . . 0.0 110.062 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -164.95 23.01 0.06 Allowed 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.44 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 118.305 -0.855 . . . . 0.0 112.394 179.86 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -169.25 -38.94 0.02 OUTLIER 'General case' 0 C--O 1.21 -0.975 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.942 -178.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 94.38 148.48 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.976 0.91 . . . . 0.0 109.476 -179.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 9.3 tt -52.34 -40.35 61.82 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -176.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -67.05 -39.58 86.93 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.353 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -70.68 -43.5 68.95 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.03 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 64.6 m95 -58.85 -48.46 81.28 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.06 -47.32 85.19 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.458 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 2.5 m -61.54 -31.83 71.87 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.337 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 8.8 tp -56.0 -11.51 1.1 Allowed 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -68.68 -18.86 64.34 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -63.87 -44.8 91.99 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 14.1 m95 -79.96 -22.79 42.21 Favored 'General case' 0 CA--C 1.553 1.062 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -176.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 65.89 -68.93 0.12 Allowed 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 119.976 1.262 . . . . 0.0 112.435 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -52.15 -51.88 55.21 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 8.8 tp -67.24 -28.96 44.29 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.961 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 22.4 m -58.94 -48.6 80.91 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.976 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -68.8 -43.94 74.61 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.476 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 19.9 t90 -63.49 -19.65 64.93 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -88.97 -2.62 58.67 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.448 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -134.75 -41.33 0.77 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 120.291 -0.563 . . . . 0.0 111.83 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -62.59 -18.1 61.46 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -36.81 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 119.447 -0.901 . . . . 0.0 110.268 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -62.82 -40.2 96.65 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 38.1 mm -61.68 -46.91 95.53 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.561 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -67.45 -28.46 67.9 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.409 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.36 -43.58 86.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 21.7 mm -67.33 -42.08 87.17 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 C-N-CA 120.324 -0.551 . . . . 0.0 109.665 179.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 95.9 mt -60.69 -41.32 87.82 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.69 -178.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 17.2 m -67.45 -10.95 13.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 C-N-CA 119.119 -1.033 . . . . 0.0 112.934 -176.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -91.56 -8.47 63.95 Favored Glycine 0 CA--C 1.559 2.821 0 C-N-CA 120.055 -1.069 . . . . 0.0 114.424 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 75.5 m -88.81 -34.31 17.1 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.322 1.561 . . . . 0.0 112.847 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -31.86 49.92 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.755 -178.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -64.92 -34.76 72.65 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 C-N-CA 121.435 -0.106 . . . . 0.0 111.068 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.9 -55.38 31.22 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.611 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 8.6 tt -60.72 -46.34 90.78 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 66.1 mtp85 -55.28 -35.78 65.41 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -178.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 68.2 mt -59.23 -41.59 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 53.4 t -56.57 -28.09 26.5 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.992 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.209 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . 0.444 ' O ' HD21 ' C' ' 702' ' ' LEU . 4.5 t80 -55.34 -34.94 64.67 Favored 'General case' 0 C--O 1.206 -1.232 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.99 -36.04 78.39 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -176.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 16.6 m -67.79 -39.68 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -176.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . 0.444 HD21 ' O ' ' C' ' 699' ' ' PHE . 0.0 OUTLIER -65.83 -24.12 66.83 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 118.431 -1.308 . . . . 0.0 111.617 -178.821 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 57.3 m -59.19 -40.63 86.32 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 15.7 tp -59.06 -27.08 65.19 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 120.295 -0.562 . . . . 0.0 109.911 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 12.3 t -74.27 -26.74 20.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.976 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -60.87 -9.43 4.13 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 5.9 mtt-85 -90.64 -23.91 20.65 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.307 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 49.9 t -91.98 -35.99 7.42 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.548 0 C-N-CA 120.921 -0.311 . . . . 0.0 110.254 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 65.2 ttp85 . . . . . 0 CA--C 1.539 0.527 0 CA-C-O 121.123 0.487 . . . . 0.0 110.607 -179.842 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -122.86 146.81 47.24 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -157.97 170.16 22.95 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.14 -0.624 . . . . 0.0 111.368 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 4.6 tt -61.76 -40.37 94.92 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.386 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -71.27 -26.63 62.97 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.104 -179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 33.8 mtpt -70.17 -43.87 69.93 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.567 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 89.8 m95 -66.83 -47.98 70.33 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.586 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.36 -30.79 68.66 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 120.471 -0.492 . . . . 0.0 111.01 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.2 t -58.12 -32.47 68.16 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.249 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 25.0 mt -60.01 -11.92 6.89 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.596 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 16.1 m95 -67.93 -42.2 81.39 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.855 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -63.72 -15.4 58.42 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.856 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . 0.556 ' O ' ' N ' ' A' ' 674' ' ' ASP . 93.4 m95 -103.19 16.91 25.34 Favored 'General case' 0 C--O 1.21 -0.99 0 CA-C-O 118.742 -0.647 . . . . 0.0 111.776 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -7.24 -49.91 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 115.47 1.655 . . . . 0.0 115.47 -178.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . 0.556 ' N ' ' O ' ' A' ' 672' ' ' TRP . 25.8 t70 -50.8 -52.34 41.96 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 119.175 -0.44 . . . . 0.0 111.459 179.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 8.5 tp -68.65 -30.74 48.29 Favored 'Isoleucine or valine' 0 C--N 1.354 0.779 0 C-N-CA 119.477 -0.889 . . . . 0.0 111.131 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.4 m -59.2 -44.49 92.25 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 58.4 m-80 -60.4 -44.18 95.95 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 54.6 t90 -58.15 -34.86 70.75 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.153 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 53.5 mt -84.6 -2.82 57.99 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -136.29 7.81 3.13 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -179.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -129.52 -27.62 2.37 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 120.197 -0.601 . . . . 0.0 111.769 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 16.6 tt -61.49 -37.73 78.47 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.149 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 34.4 ttp-105 -55.75 -48.38 75.34 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 120.292 -0.563 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.68 -45.93 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -52.78 -40.91 63.62 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 121.219 -0.192 . . . . 0.0 111.335 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.3 mp -58.16 -38.04 65.79 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 CA-C-O 119.24 -0.41 . . . . 0.0 110.544 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.37 -43.26 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.198 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 4.0 mp -62.27 -41.46 91.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.49 3.74 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -109.31 -9.86 24.83 Favored Glycine 0 CA--C 1.545 1.911 0 C-N-CA 120.911 -0.661 . . . . 0.0 111.492 178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.7 m -88.17 -28.66 21.07 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 117.098 0.449 . . . . 0.0 112.051 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.51 -32.32 49.94 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.335 -178.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 4.8 tp -53.88 -39.56 40.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.569 -178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -70.57 -36.97 68.37 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 177.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.65 -31.85 64.77 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.533 -0.334 . . . . 0.0 110.962 179.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -61.61 -35.92 79.26 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 61.1 mt -59.15 -41.38 83.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 CA-C-O 118.973 -0.537 . . . . 0.0 112.092 -176.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 5.3 p -56.76 -29.09 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 118.865 0.757 . . . . 0.0 111.473 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -55.68 -35.37 65.94 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.242 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.39 -35.41 65.28 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.383 -178.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 1.3 p -59.6 -31.67 47.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 11.3 tp -58.64 -24.53 61.33 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.796 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 68.4 m -57.57 -43.24 84.4 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.396 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.45 -42.93 99.82 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.57 -34.17 66.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.19 178.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -67.27 -32.14 72.95 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.584 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -73.94 -22.2 59.75 Favored 'General case' 0 C--O 1.219 -0.506 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.556 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 59.6 t -82.97 -36.18 12.82 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.496 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.127 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -142.79 -76.34 0.26 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.374 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.607 179.725 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 4.3 mp . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.81 136.96 53.08 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.597 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -149.82 175.38 11.68 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 123.34 0.4 . . . . 0.0 110.797 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -40.22 94.91 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.792 178.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -68.97 -26.33 64.98 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.867 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 4.0 tttm -68.85 -41.45 78.44 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.318 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -72.93 -53.58 10.92 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.297 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.31 -25.84 50.08 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.704 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 53.6 p -58.62 -31.84 68.46 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.898 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 67.8 mt -71.84 -15.07 62.13 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 18.7 m95 -69.08 -2.4 10.04 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -74.36 -48.16 29.78 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.029 -0.669 . . . . 0.0 110.696 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 6.7 p90 -103.3 -22.49 13.69 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.131 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.02 2.25 0.39 Allowed 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.3 -52.97 59.76 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 118.283 0.492 . . . . 0.0 111.435 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.8 tp -68.21 -31.46 51.71 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.619 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.073 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.1 m -59.2 -43.21 92.24 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.449 -179.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -67.28 -38.58 85.3 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.377 -179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -72.15 -46.25 57.23 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.635 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 14.6 mt -75.33 -33.14 61.1 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -84.74 10.46 11.32 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 119.947 -0.701 . . . . 0.0 112.41 -178.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -128.96 -5.55 5.03 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 120.759 -0.377 . . . . 0.0 111.98 179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.2 pp -67.74 -43.14 86.66 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.713 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.519 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 19.1 mtp-105 -55.88 -47.89 76.55 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.186 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 84.3 mt -67.91 -38.48 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.389 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -55.26 -37.91 67.87 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 121.06 -0.256 . . . . 0.0 111.61 -178.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 16.2 mm -60.99 -40.81 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.034 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.87 -41.57 83.24 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 32.1 mm -57.51 -42.84 81.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.501 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 48.6 t -68.57 -8.65 10.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.554 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.51 -37.87 13.46 Favored Glycine 0 C--N 1.349 1.259 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.64 -27.59 62.23 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.825 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.13 -54.59 43.31 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.518 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -55.57 -28.73 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.917 -179.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.35 -50.49 44.18 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 119.46 -1.352 . . . . 0.0 111.235 -179.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.76 -31.83 65.0 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.59 -30.66 13.83 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 7.1 tp -58.78 -41.04 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 9.2 p -56.13 -28.11 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-N 118.279 0.491 . . . . 0.0 111.517 -179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -55.25 -26.84 42.37 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.587 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.48 -36.24 66.39 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 120.402 -0.519 . . . . 0.0 109.832 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 77.9 t -64.82 -41.34 91.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 10.4 tt -61.13 -38.34 86.03 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.476 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 24.3 p -59.6 -32.66 70.6 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.273 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.91 -42.33 97.44 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.103 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 59.8 t -63.1 -18.99 22.64 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.954 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.41 -34.05 75.98 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.84 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -73.81 -26.59 60.7 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.546 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 47.2 t -82.85 -36.12 12.9 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.505 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.336 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 29.1 ttt85 -150.36 -67.35 0.2 Allowed 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.824 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.419 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 N--CA 1.487 1.384 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.42 -160.67 0.78 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 178.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.79 141.93 26.08 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 119.884 -0.726 . . . . 0.0 110.897 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 9.7 tt -61.33 -40.17 93.22 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.924 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -74.06 -25.7 59.98 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.868 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -67.21 -39.83 86.35 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.974 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -62.25 -50.35 72.07 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.55 -35.62 80.68 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.299 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 59.7 p -57.73 -31.93 66.93 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.073 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 62.7 mt -60.71 -10.1 4.89 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 120.354 -0.538 . . . . 0.0 111.991 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -68.73 -13.24 62.26 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.877 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -62.82 -44.68 95.52 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.981 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -79.8 -12.8 59.75 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 119.638 -0.825 . . . . 0.0 113.146 -177.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.3 t80 69.17 -63.99 0.35 Allowed 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.734 1.152 . . . . 0.0 112.286 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -57.21 -37.56 72.39 Favored 'General case' 0 C--O 1.218 -0.588 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 8.5 tp -67.73 -37.2 78.19 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.885 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 4.4 m -60.97 -49.52 77.12 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.272 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -70.0 -45.07 68.06 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 120.43 -0.508 . . . . 0.0 109.634 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -55.89 -23.21 29.94 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.297 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 48.2 mt -94.12 -25.48 17.13 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.448 -0.501 . . . . 0.0 112.148 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -109.27 11.94 25.1 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -122.26 -28.01 4.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.613 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.2 pp -61.2 -41.7 90.55 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.759 0 C-N-CA 120.466 -0.493 . . . . 0.0 111.582 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 31.7 ttp-105 -58.47 -48.29 81.24 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.429 -0.508 . . . . 0.0 111.119 -179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 78.8 mt -67.67 -43.28 86.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -52.82 -28.18 21.57 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.902 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 20.8 mm -58.25 -38.05 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.041 -178.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.5 mt -61.3 -42.0 91.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 68.5 mt -63.49 -41.16 91.7 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.73 178.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 90.2 t -67.18 -26.15 35.66 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 CA-C-O 118.578 -0.725 . . . . 0.0 112.412 -176.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -83.94 2.86 87.03 Favored Glycine 0 CA--C 1.55 2.225 0 C-N-CA 119.855 -1.164 . . . . 0.0 113.046 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 67.6 m -88.98 -34.57 16.8 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.657 1.229 . . . . 0.0 112.603 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -31.93 71.37 Favored 'General case' 0 C--O 1.22 -0.492 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.592 -178.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -63.08 -32.39 56.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.81 -41.34 99.61 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.495 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.41 -31.47 63.92 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 117.351 0.575 . . . . 0.0 112.389 -179.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -50.71 -36.18 34.93 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -178.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 1.3 pt -59.4 -41.39 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 CA-C-N 119.273 0.942 . . . . 0.0 113.311 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 5.2 m -56.41 -27.77 25.2 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.838 0 C-N-CA 119.088 -1.045 . . . . 0.0 111.541 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -54.84 -35.43 63.97 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.838 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.67 66.45 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.952 -179.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 2.7 p -59.74 -31.48 47.31 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.961 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.7 tp -58.38 -26.2 62.93 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.746 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 2.3 m -58.56 -39.28 79.82 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.054 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 15.5 tp -59.55 -39.47 84.1 Favored 'General case' 0 C--O 1.218 -0.568 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 12.8 t -76.1 -16.79 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.156 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -60.63 -28.24 68.4 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 34.9 ptt85 -78.66 -24.28 45.24 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 120.612 -0.435 . . . . 0.0 111.53 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 18.6 t -100.23 26.24 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-O 120.661 0.267 . . . . 0.0 110.795 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 . . . . . 0 N--CA 1.469 0.515 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.867 179.939 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.702 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 45.0 mt -132.5 -73.52 0.51 Allowed 'General case' 0 C--O 1.213 -0.816 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.52 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 69.33 147.52 0.06 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.642 0.258 . . . . 0.0 111.034 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.56 -17.59 2.21 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.851 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -73.86 -37.13 64.87 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.042 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -70.29 -42.37 72.15 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.391 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -60.36 -50.06 75.12 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.458 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.99 80.11 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.094 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.2 m -57.44 -32.49 66.96 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.397 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.61 -14.69 45.83 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.882 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -68.44 -8.95 45.27 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.117 -0.633 . . . . 0.0 111.576 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -62.61 -48.02 81.22 Favored 'General case' 0 C--O 1.218 -0.585 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.183 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -102.47 -23.01 13.96 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.016 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 7.2 t80 51.8 6.99 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.81 -52.81 58.51 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 118.873 0.76 . . . . 0.0 111.534 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.39 -42.39 84.07 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.685 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 1.4 m -62.76 -44.81 95.21 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.233 -178.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -59.95 -46.74 88.43 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.304 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 7.8 t-105 -71.0 -46.51 62.14 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 120.628 -0.429 . . . . 0.0 112.134 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 96.5 mt -74.79 -11.25 60.11 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -176.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -70.35 -3.47 17.53 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 118.927 -1.109 . . . . 0.0 110.884 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -149.44 12.91 0.83 Allowed 'General case' 0 C--N 1.352 0.685 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.22 178.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 14.9 tt -55.76 -39.63 56.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 118.841 0.746 . . . . 0.0 109.265 178.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 -70.16 -40.3 74.82 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.495 -0.482 . . . . 0.0 109.779 178.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 31.7 mt -59.73 -42.1 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.63 -37.65 58.82 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.886 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 17.5 mm -58.45 -38.66 71.33 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 C-N-CA 120.214 -0.594 . . . . 0.0 110.344 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.5 -42.91 85.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 56.4 mt -60.63 -42.91 93.51 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 57.7 t -68.5 -2.49 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.21 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.883 179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -92.94 -34.04 7.03 Favored Glycine 0 C--N 1.352 1.417 0 N-CA-C 109.966 -1.253 . . . . 0.0 109.966 178.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 56.8 m -80.36 -24.87 39.52 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -58.42 -42.62 87.63 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.224 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 3.5 tp -65.3 -28.07 43.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.52 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.83 -51.59 23.77 Favored Glycine 0 C--O 1.212 -1.257 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 178.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.41 -31.84 64.28 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-O 120.491 0.186 . . . . 0.0 110.501 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 0.1 OUTLIER -56.61 -37.24 70.42 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.601 179.725 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.3 tp -60.62 -41.2 87.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 119.722 -0.791 . . . . 0.0 110.406 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 2.2 t -56.89 -28.97 29.6 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.632 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 13.8 m-85 -58.32 -34.57 70.74 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 178.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.7 -35.72 63.91 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 25.1 m -60.62 -36.77 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.766 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 6.2 tt -58.99 -30.5 68.01 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.222 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 38.5 t -58.65 -44.97 90.25 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.794 -179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 5.3 tt -66.91 -36.07 81.43 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-O 120.927 0.394 . . . . 0.0 110.112 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 59.7 t -60.59 -26.87 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.695 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -62.59 -34.13 76.37 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 112.322 0.489 . . . . 0.0 112.322 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -80.01 -6.2 57.16 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 120.146 -0.622 . . . . 0.0 112.352 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 17.1 t -89.28 25.98 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.508 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 -56.63 112.23 1.23 Allowed 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.441 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 . . . . . 0 C--O 1.219 -0.54 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.999 -179.821 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 4.6 mp . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 mt 54.63 97.68 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.747 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -151.82 -179.69 7.67 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.016 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.9 tt -52.88 -36.15 58.79 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.073 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.05 -37.5 69.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.622 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -46.19 65.5 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.72 -179.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 93.4 m95 -62.57 -38.45 90.13 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.59 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.05 -31.46 66.16 Favored 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.082 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 6.9 t -57.37 -32.08 66.43 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.409 -0.516 . . . . 0.0 110.292 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.0 -15.61 33.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.96 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 9.9 m95 -68.66 -2.97 10.33 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 118.965 -0.541 . . . . 0.0 112.405 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -89.04 -49.57 6.68 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.935 -178.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . 0.401 ' O ' ' N ' ' B' ' 674' ' ' ASP . 4.7 p-90 -104.21 -24.15 13.17 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.666 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 2.4 t80 47.5 -4.18 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.336 0 N-CA-C 116.951 2.204 . . . . 0.0 116.951 176.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' B' ' 672' ' ' TRP . 2.7 m-20 -63.73 -54.39 36.23 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 121.061 1.755 . . . . 0.0 113.053 -177.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 10.7 mm -69.91 -27.59 33.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.837 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 34.1 m -58.66 -46.81 86.36 Favored 'General case' 0 C--O 1.22 -0.478 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.7 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -65.49 -31.74 72.97 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 120.489 -0.484 . . . . 0.0 109.855 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 33.8 t90 -67.38 -45.52 76.0 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.113 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 64.4 mt -81.12 -23.27 38.46 Favored 'General case' 0 C--O 1.22 -0.464 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -177.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 9.3 t90 -92.53 0.62 57.45 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.83 -0.748 . . . . 0.0 112.385 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -130.23 -1.12 4.56 Favored 'General case' 0 C--O 1.218 -0.603 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.572 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 6.4 tp -65.89 -44.1 92.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 C-N-CA 120.512 -0.475 . . . . 0.0 111.664 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.94 -40.03 75.65 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.283 -179.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 92.8 mt -68.17 -43.86 84.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -54.74 -28.4 48.17 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.39 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 19.0 mm -58.65 -40.36 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.921 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.81 -41.63 83.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 3.7 mp -61.94 -41.46 91.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.214 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 46.5 t -67.8 -10.13 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 120.424 -0.51 . . . . 0.0 112.025 -177.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -77.81 -39.99 23.07 Favored Glycine 0 C--N 1.346 1.112 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 24.2 m -74.07 -17.26 60.98 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.706 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -33.7 68.97 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.27 -179.071 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 2.3 pp -70.9 -39.05 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.763 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.41 -42.93 98.94 Favored Glycine 0 C--O 1.217 -0.926 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.26 -31.4 63.54 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 120.584 0.231 . . . . 0.0 111.088 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.27 -30.48 11.9 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 7.2 tp -58.9 -40.75 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -175.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 7.4 p -55.96 -28.74 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 118.912 0.778 . . . . 0.0 111.747 -178.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -55.52 -24.17 30.38 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -48.61 -34.63 11.98 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -177.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 33.3 m -58.66 -31.16 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.23 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 39.1 tp -58.24 -35.76 72.2 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.366 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.2 m -58.23 -31.89 67.81 Favored 'General case' 0 C--O 1.218 -0.603 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.689 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.74 -43.5 75.76 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 120.187 -0.605 . . . . 0.0 112.078 -178.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 34.2 m -95.45 -10.3 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -60.62 -15.34 27.21 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 119.832 -0.747 . . . . 0.0 111.662 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 21.3 ptt180 -85.89 -34.39 20.99 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 120.489 -0.484 . . . . 0.0 111.189 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 27.8 m -91.4 26.08 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 120.858 -0.337 . . . . 0.0 111.381 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 23.7 mmt180 -50.8 146.61 5.69 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.185 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.662 -179.982 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 4.6 tp 53.96 -153.62 0.28 Allowed 'General case' 0 CA--C 1.549 0.94 0 CA-C-O 118.447 -0.787 . . . . 0.0 110.193 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 122.21 168.68 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 125.861 1.664 . . . . 0.0 109.685 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.08 -40.07 92.31 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.751 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -72.22 -23.83 61.3 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.862 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -69.05 -41.59 77.42 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.844 -178.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -65.37 -44.08 88.74 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.317 -179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.09 -30.67 60.17 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.391 -178.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 92.9 p -59.91 -32.79 71.09 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.904 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 32.6 mt -66.59 -6.9 16.93 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -77.2 -17.6 58.38 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -62.77 -50.01 72.72 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 119.009 -1.077 . . . . 0.0 110.953 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . 0.411 ' O ' ' N ' ' C' ' 674' ' ' ASP . 7.7 p90 -96.03 -22.88 17.09 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 43.3 p90 45.45 3.21 0.0 OUTLIER 'General case' 0 C--N 1.364 1.206 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' C' ' 672' ' ' TRP . 7.2 t0 -64.24 -53.63 46.04 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 120.069 1.304 . . . . 0.0 110.463 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 8.4 tp -69.54 -29.23 40.81 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.918 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.357 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.2 m -58.63 -38.03 77.2 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 123.123 0.264 . . . . 0.0 111.393 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -59.97 -47.08 87.3 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 120.009 -0.677 . . . . 0.0 109.947 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -72.53 -37.08 68.41 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.238 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -2.45 6.29 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -142.57 153.31 43.42 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-O 122.083 0.944 . . . . 0.0 112.187 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 5.4 p90 56.98 -3.81 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.4 pp -62.98 -34.88 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 119.572 1.078 . . . . 0.0 109.244 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 19.1 ttp-105 -54.47 -31.17 55.16 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.117 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 89.5 mt -59.49 -48.08 88.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 120.516 -0.473 . . . . 0.0 109.834 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -53.81 -27.96 32.49 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.284 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 31.4 mm -57.83 -38.09 63.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.942 -177.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.3 -42.11 86.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 3.8 mp -67.97 -41.56 84.74 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.731 179.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 93.3 t -67.82 -31.09 50.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.312 -178.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -77.42 13.45 11.14 Favored Glycine 0 CA--C 1.543 1.81 0 CA-C-N 120.166 1.348 . . . . 0.0 112.24 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 8.9 m -88.69 -34.13 17.32 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 117.797 0.798 . . . . 0.0 111.569 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -32.46 53.2 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.416 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.14 -37.78 44.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.584 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.28 -42.52 97.36 Favored Glycine 0 CA--C 1.537 1.419 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 177.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.46 -30.46 62.92 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -49.75 -36.0 24.26 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -177.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 3.7 pt -59.37 -41.48 84.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 CA-C-N 119.577 1.081 . . . . 0.0 113.551 -176.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 12.3 m -56.38 -27.94 25.41 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.894 0 C-N-CA 119.209 -0.996 . . . . 0.0 111.542 -178.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -54.8 -34.83 63.2 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.11 -35.86 65.09 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 119.197 -0.43 . . . . 0.0 111.803 -177.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 9.8 p -64.39 -33.08 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.339 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.89 -40.48 88.89 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.521 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 16.1 m -60.51 -34.87 74.71 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.348 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 24.8 tp -58.29 -42.83 87.45 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.319 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 19.0 m -85.78 -10.8 11.34 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -61.34 -25.95 67.49 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.546 -0.461 . . . . 0.0 111.789 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -80.07 -21.36 43.48 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 120.455 -0.498 . . . . 0.0 112.252 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 29.5 m -96.12 -29.72 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.0 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.507 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.375 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 29.1 mt . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 5.5 mp -126.31 -142.51 0.29 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-O 118.647 -0.692 . . . . 0.0 109.841 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 73.38 130.94 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.429 1.013 . . . . 0.0 109.096 -178.211 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -19.2 2.35 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.065 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -63.62 -48.44 77.33 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -71.48 -44.43 64.76 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.73 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -58.5 -35.23 71.92 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.577 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -53.75 -47.36 70.73 Favored 'General case' 0 C--O 1.215 -0.756 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.8 t -53.44 -32.56 50.4 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.321 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -14.56 59.32 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.22 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -68.46 -17.15 64.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.78 -179.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -68.03 -48.6 65.21 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.534 -178.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 4.7 p90 -103.46 -23.15 13.55 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 121.304 -0.158 . . . . 0.0 111.22 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 p90 40.58 18.32 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -63.87 -53.12 55.6 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 118.741 0.701 . . . . 0.0 110.945 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.2 tp -68.86 -27.93 37.71 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.912 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.093 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.0 m -58.96 -39.33 81.36 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.511 -179.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.04 -47.06 86.41 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.597 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -72.69 -46.25 54.75 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.9 tp -75.41 -33.26 60.95 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -176.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 13.8 t90 -89.92 4.78 48.94 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 119.691 -0.803 . . . . 0.0 112.449 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -125.06 2.54 7.97 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 120.255 -0.578 . . . . 0.0 112.349 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.6 pp -55.88 -43.34 74.18 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 C-N-CA 119.884 -0.727 . . . . 0.0 110.838 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.46 -48.28 56.62 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 121.114 -0.235 . . . . 0.0 110.698 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 97.2 mt -60.34 -46.72 94.59 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.361 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -52.76 -28.5 22.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 27.4 mm -58.12 -42.28 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.652 -178.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 47.7 mt -58.28 -41.73 81.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 120.031 -0.668 . . . . 0.0 109.342 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 36.3 mm -57.18 -41.95 78.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.554 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 59.4 t -68.13 -6.42 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.073 0 C-N-CA 120.659 -0.417 . . . . 0.0 111.339 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -70.67 -40.86 65.61 Favored Glycine 0 C--N 1.35 1.338 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 178.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -72.23 -33.46 67.57 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.327 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.68 -47.39 85.53 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.581 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -67.68 -35.14 71.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.641 -179.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -66.2 -40.19 94.77 Favored Glycine 0 CA--C 1.531 1.093 0 N-CA-C 110.039 -1.225 . . . . 0.0 110.039 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 3.1 tt -56.62 -31.82 64.68 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 115.665 -0.267 . . . . 0.0 111.486 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -50.79 -35.26 31.08 Favored 'General case' 0 C--O 1.215 -0.763 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 20.5 tt -58.49 -40.53 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -175.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 16.0 m -55.69 -28.69 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 119.041 0.837 . . . . 0.0 111.1 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -56.41 -35.93 68.35 Favored 'General case' 0 C--O 1.214 -0.811 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.836 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.55 -50.7 71.11 Favored 'General case' 0 C--O 1.219 -0.511 0 O-C-N 123.262 0.351 . . . . 0.0 111.28 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 22.7 m -68.56 -38.83 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.115 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.1 tt -66.17 -24.64 66.68 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.424 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 68.9 m -61.68 -44.57 96.69 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.757 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.8 tp -64.36 -36.1 83.03 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.065 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 87.4 t -60.79 -36.31 70.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.951 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -60.93 -18.16 55.29 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.883 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 10.2 ttm180 -73.87 -40.32 63.31 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 121.198 -0.201 . . . . 0.0 110.915 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 16.3 t -96.14 25.44 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.595 -179.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 42.2 ttm-85 -65.62 123.23 19.13 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.43 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 8.6 mp0 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.629 179.808 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 7.8 mp . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 19.2 tp 59.77 153.69 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 121.623 0.725 . . . . 0.0 111.565 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -95.62 42.47 1.09 Allowed 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.224 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 7.4 tt -54.6 -41.57 70.09 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.986 -179.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -75.07 -34.67 61.83 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.725 178.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 11.5 tmtt? -70.57 -34.56 72.33 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 123.44 0.462 . . . . 0.0 110.766 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -58.6 -54.8 43.0 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -70.68 -42.96 70.02 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.666 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 37.4 t -54.57 -31.28 56.43 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.358 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.58 -25.65 39.37 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.111 -179.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -68.52 -2.81 9.62 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.104 -0.638 . . . . 0.0 111.654 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -80.35 -28.7 37.99 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.795 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 7.4 m95 -87.62 -23.14 24.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.521 -179.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 66.5 -59.85 0.34 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 178.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -57.44 -52.63 64.59 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -177.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 5.2 tp -68.54 -34.45 65.49 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.811 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.4 m -60.37 -37.4 80.62 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 120.036 -0.665 . . . . 0.0 110.241 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -59.95 -46.44 89.39 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 7.0 t90 -71.64 -30.6 65.93 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.087 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.96 -7.51 58.1 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -118.25 -20.2 8.66 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 120.642 -0.423 . . . . 0.0 112.102 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -95.2 0.87 54.44 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.25 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 4.7 pt -56.39 -43.46 77.52 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.839 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 25.9 ttp-105 -55.68 -46.55 77.56 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.812 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.3 mp -67.39 -37.84 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -55.32 -41.54 72.56 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.074 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 3.5 mm -60.95 -45.15 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.373 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 65.7 mt -58.93 -41.48 83.16 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 62.2 mt -56.9 -41.87 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 47.0 t -68.37 -2.24 1.87 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.12 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.261 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -83.77 -42.73 7.58 Favored Glycine 0 C--N 1.349 1.274 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 68.0 m -73.43 -21.8 60.37 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.932 -0.307 . . . . 0.0 111.063 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.15 -41.63 75.71 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.453 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -72.25 -32.78 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.525 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.3 -47.01 66.07 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 119.661 -1.257 . . . . 0.0 111.419 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.82 -31.77 65.04 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.732 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -50.63 -31.11 15.12 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 19.0 tt -59.42 -41.1 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 N-CA-C 113.129 0.788 . . . . 0.0 113.129 -175.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 8.5 p -56.43 -28.72 27.09 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.787 0 CA-C-N 118.474 0.579 . . . . 0.0 111.932 -178.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -55.52 -25.79 39.35 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -50.12 -35.6 26.42 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 33.3 m -59.85 -33.38 52.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.595 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 21.2 tp -61.65 -28.06 69.11 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.314 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 17.3 m -57.98 -34.2 69.71 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 120.971 -0.292 . . . . 0.0 111.571 -179.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 14.3 tp -77.93 -42.33 33.4 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.748 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 48.8 t -66.3 -13.58 16.25 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.345 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -60.84 -34.2 74.2 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.973 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 -76.13 -35.68 59.15 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.049 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 16.6 t -89.1 26.07 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.521 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -60.15 116.38 4.16 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.554 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.702 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 5.7 mt -117.39 151.55 36.8 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.013 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -174.0 -177.9 1.42 Allowed 'General case' 0 C--O 1.22 -0.493 0 O-C-N 123.306 0.379 . . . . 0.0 110.186 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.65 -40.13 86.68 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 120.873 0.368 . . . . 0.0 110.454 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.35 -28.99 66.69 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.56 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 32.9 tptt -70.11 -43.29 71.34 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.849 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -73.04 -49.16 30.27 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.088 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.18 -14.73 40.55 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.664 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 60.3 p -65.71 -31.69 72.83 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.533 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 8.6 mp -77.51 -6.06 52.23 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -72.12 -28.55 63.34 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -62.72 -49.89 73.25 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 118.633 -1.227 . . . . 0.0 110.756 -178.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . 0.418 ' O ' ' N ' ' C' ' 674' ' ' ASP . 6.1 p90 -95.86 -23.35 16.95 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 51.6 p90 38.66 19.12 0.0 OUTLIER 'General case' 0 C--N 1.363 1.168 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' C' ' 672' ' ' TRP . 1.0 OUTLIER -64.19 -54.0 40.48 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.448 179.855 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 1.5 pp -70.15 -33.56 55.32 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 CA-C-O 121.159 0.504 . . . . 0.0 110.491 177.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 21.0 m -58.64 -33.95 70.64 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.796 -177.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -59.9 -47.94 83.73 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 119.481 -0.888 . . . . 0.0 109.961 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . 0.421 ' CD1' ' C ' ' C' ' 678' ' ' TRP . 0.0 OUTLIER -73.43 -46.05 50.86 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.121 178.728 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 2.5 tt -67.62 -33.44 74.98 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 7.5 t90 -80.12 -17.27 53.01 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.4 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -93.03 -6.43 48.27 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.519 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 50.2 mm -56.04 -47.6 80.06 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -58.08 -42.01 84.68 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.3 178.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 41.4 mm -61.2 -48.53 88.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.861 -178.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -69.63 -28.87 66.28 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.2 mp -58.25 -50.04 79.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.584 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 40.5 mt -59.08 -41.36 83.24 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.584 0 C-N-CA 120.36 -0.536 . . . . 0.0 109.629 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 84.1 mt -56.67 -41.88 75.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.88 -31.41 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.6 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.88 -43.44 92.54 Favored Glycine 0 CA--C 1.537 1.417 0 CA-C-N 119.147 0.885 . . . . 0.0 111.66 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 11.8 m -78.59 -20.31 50.77 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 117.501 0.651 . . . . 0.0 112.122 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.5 tp -59.72 -32.95 71.01 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.096 -178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.2 pp -65.47 -36.47 77.75 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.38 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.68 -36.84 87.91 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 120.74 -0.743 . . . . 0.0 111.489 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 7.8 tt -56.42 -32.83 65.24 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 117.481 0.64 . . . . 0.0 111.156 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.84 -36.68 38.84 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 120.371 0.129 . . . . 0.0 111.28 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 53.5 mt -59.82 -42.03 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.175 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 39.4 t -70.91 -33.5 52.33 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.228 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.9 -35.48 71.1 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.73 -35.0 65.66 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 7.0 p -59.15 -31.83 46.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 119.989 -0.685 . . . . 0.0 111.389 -178.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.3 pp -58.96 -25.1 63.25 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.672 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 26.1 p -57.86 -40.38 80.02 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.052 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 14.7 tp -59.02 -31.43 68.82 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 120.523 -0.471 . . . . 0.0 109.786 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.7 t -81.09 -38.14 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.976 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -61.1 -8.55 3.52 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -178.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 3.0 ppt_? -81.76 -14.67 56.15 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 45.2 t -83.0 -36.18 12.78 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.262 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 21.2 ptt-85 . . . . . 0 C--O 1.219 -0.53 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.771 -179.856 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.941 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 10.5 mp -118.76 136.15 54.13 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.662 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -141.98 152.29 43.31 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.072 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.3 tt -61.7 -39.84 92.9 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.141 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -26.27 62.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.618 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 19.1 tptt -70.49 -46.11 64.37 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-O 120.852 0.358 . . . . 0.0 111.182 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 64.1 m95 -71.82 -47.67 51.61 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.142 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.54 -39.3 83.51 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 120.305 -0.558 . . . . 0.0 111.608 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 20.5 t -58.4 -32.03 68.24 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.895 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.15 -25.01 65.18 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.211 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -68.43 -3.11 10.2 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.915 -0.564 . . . . 0.0 112.24 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -74.85 -50.09 18.25 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 119.128 -1.029 . . . . 0.0 112.6 -178.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -104.96 -9.86 17.64 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 118.619 0.645 . . . . 0.0 111.798 177.2 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 1.5 t80 52.06 17.17 0.64 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 176.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -63.73 -52.74 59.13 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 675' ' ' ILE . . . . . 0.416 HD12 HG21 ' A' ' 675' ' ' ILE . 0.4 OUTLIER -68.38 -34.61 66.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 119.486 -0.886 . . . . 0.0 111.699 -178.384 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -33.78 71.02 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.121 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.38 -46.79 87.68 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.153 -178.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -72.9 -46.46 52.54 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 96.2 mt -84.61 -19.74 32.51 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -174.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -83.91 13.57 4.81 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.728 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -130.7 -35.48 1.46 Allowed 'General case' 0 C--N 1.35 0.62 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.57 -36.77 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.057 178.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -60.18 -48.78 80.29 Favored 'General case' 0 C--N 1.349 0.553 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.14 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.32 -43.32 97.94 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -52.74 -27.67 18.78 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 38.7 mm -57.64 -51.57 68.32 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.236 -177.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 4.2 mp -61.77 -41.65 91.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.253 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 90.6 mt -56.54 -40.34 67.81 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.438 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 57.5 t -67.12 -2.14 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 119.905 -0.718 . . . . 0.0 111.22 -177.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -73.99 -49.36 13.36 Favored Glycine 0 C--N 1.349 1.252 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 35.4 m -66.47 -22.48 66.2 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.925 178.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.79 -32.93 54.35 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.312 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 1.3 pp -80.58 -35.62 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.238 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.2 -45.5 95.9 Favored Glycine 0 C--N 1.342 0.911 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.6 tt -56.57 -42.17 78.17 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 54.0 mmt-85 -50.74 -33.92 24.99 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 122.702 0.401 . . . . 0.0 112.001 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 66.9 mt -56.95 -39.98 69.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.765 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 17.1 m -55.48 -28.19 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 118.874 0.761 . . . . 0.0 110.787 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -57.95 -36.68 72.88 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.678 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.05 -50.44 73.72 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.931 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 7.6 p -67.2 -36.97 78.25 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.97 -25.75 67.07 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 1.3 m -57.97 -44.36 87.02 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 121.163 -0.215 . . . . 0.0 110.89 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 3.6 tt -73.24 -27.77 61.77 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.096 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 66.2 t -60.87 -29.47 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -60.75 -17.55 49.36 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.421 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 707' ' ' ARG . . . . . 0.44 ' CZ ' ' CZ ' ' C' ' 707' ' ' ARG . 0.0 OUTLIER -73.85 -34.72 64.63 Favored 'General case' 0 C--O 1.219 -0.521 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.799 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 22.0 t -82.82 -26.74 8.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.331 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 66.29 111.49 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 45.1 tp60 . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.414 179.875 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 8.1 mp -50.47 135.53 22.25 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 121.199 -0.2 . . . . 0.0 110.775 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -157.27 164.42 37.68 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 120.547 -0.461 . . . . 0.0 111.583 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.6 tt -56.08 -40.57 73.81 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.106 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -74.28 -29.41 61.65 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.041 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -61.11 -44.29 97.57 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.332 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -69.94 -51.14 35.29 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.8 -23.52 61.58 Favored 'General case' 0 C--O 1.217 -0.633 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 10.5 m -66.11 -31.78 72.84 Favored 'General case' 0 C--O 1.218 -0.582 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.368 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.7 mp -64.74 -22.03 66.89 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.788 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 24.5 m95 -68.7 -9.04 48.01 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -89.11 -47.64 7.96 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -103.14 -12.96 16.99 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 118.496 2.776 . . . . 0.0 118.496 -174.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -156.75 156.31 33.11 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 122.914 2.597 . . . . 0.0 117.309 -178.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -63.54 -29.42 70.69 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 112.583 -2.098 . . . . 0.0 112.274 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 7.2 tp -55.11 -27.0 18.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.58 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 11.7 m -58.59 -38.95 79.02 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.67 -36.2 70.56 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.381 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 34.9 t90 -55.79 -39.76 71.74 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 116.749 -0.205 . . . . 0.0 110.574 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.56 -14.99 59.97 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 16.8 t90 -101.84 -4.78 25.71 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -125.7 -2.25 7.29 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 120.328 -0.549 . . . . 0.0 112.108 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 7.1 tp -68.07 -40.39 83.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.999 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -60.35 -43.77 96.16 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.874 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 78.0 mt -68.2 -41.8 84.26 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.594 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -52.98 -28.65 24.84 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.544 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 21.6 mm -59.32 -42.78 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.539 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.4 mt -58.3 -41.78 82.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 3.0 mp -62.05 -42.01 93.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.89 -0.99 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.324 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -104.93 7.09 44.33 Favored Glycine 0 CA--C 1.541 1.712 0 C-N-CA 120.634 -0.793 . . . . 0.0 111.902 179.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 3.2 m -88.53 -34.35 17.43 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 117.374 0.587 . . . . 0.0 111.348 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -32.69 74.48 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.663 -178.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -57.26 -46.16 85.01 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.37 -178.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -71.2 -41.66 59.38 Favored Glycine 0 CA--C 1.532 1.111 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 178.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 10.5 tt -56.58 -34.9 67.61 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.595 -0.302 . . . . 0.0 111.438 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 11.7 mtm105 -50.69 -31.59 16.86 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 42.3 mm -59.62 -41.34 84.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.33 -28.66 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -56.03 -29.21 60.07 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 120.214 -0.594 . . . . 0.0 111.678 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -51.43 -35.92 41.54 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.776 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 79.7 t -60.43 -32.3 50.84 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.851 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.28 -25.82 67.81 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.257 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 23.2 t -57.44 -37.42 72.79 Favored 'General case' 0 C--O 1.22 -0.492 0 C-N-CA 121.14 -0.224 . . . . 0.0 111.24 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 26.0 tp -64.62 -31.47 72.71 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.029 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 22.0 t -88.1 -21.94 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.035 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.04 -25.78 67.16 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.754 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 68.1 mtp85 -73.7 -49.84 23.79 Favored 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 120.614 -0.434 . . . . 0.0 111.114 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 18.1 t -104.54 26.1 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.545 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -53.92 146.83 13.34 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.628 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.488 179.771 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 50.67 -176.0 0.02 OUTLIER 'General case' 0 C--O 1.215 -0.721 0 CA-C-O 120.615 0.245 . . . . 0.0 111.558 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -159.87 158.84 31.64 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -62.65 -40.73 97.96 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.245 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -74.53 -24.24 58.94 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.982 178.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -66.84 -39.5 87.63 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.12 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -60.25 -47.97 83.73 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.233 -0.587 . . . . 0.0 110.067 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.34 -29.35 70.39 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.73 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 19.3 t -64.41 -34.18 77.59 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.162 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 6.1 mp -68.68 -4.66 16.49 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -70.77 -28.81 64.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -62.63 -49.64 74.4 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.934 -177.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 672' ' ' TRP . . . . . 0.428 ' O ' ' N ' ' C' ' 674' ' ' ASP . 2.4 p90 -92.93 -22.67 19.08 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 115.635 1.717 . . . . 0.0 115.635 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 20.4 p90 43.28 8.86 0.0 OUTLIER 'General case' 0 C--N 1.359 1.015 0 N-CA-C 115.648 1.721 . . . . 0.0 115.648 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 674' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' C' ' 672' ' ' TRP . 9.2 t70 -64.24 -53.81 43.22 Favored 'General case' 0 C--N 1.349 0.586 0 CA-C-N 120.007 1.276 . . . . 0.0 110.63 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 7.8 tp -69.76 -33.22 55.22 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.718 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.243 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 13.4 m -58.85 -41.89 88.05 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -177.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -63.22 -43.66 97.47 Favored 'General case' 0 C--O 1.213 -0.829 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.297 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 3.1 t90 -72.51 -45.88 57.28 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.62 -27.03 55.57 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -92.93 7.91 42.0 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.52 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -137.51 3.68 2.56 Favored 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 120.507 -0.477 . . . . 0.0 111.858 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 3.9 tp -64.19 -41.89 93.81 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.063 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 4.6 ptt-85 -58.25 -43.45 87.87 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.159 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 82.5 mt -68.23 -39.87 81.82 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 177.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.39 -28.86 31.74 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.07 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 24.0 mm -59.78 -44.29 93.6 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.518 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.843 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 54.7 mt -58.22 -41.51 81.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.539 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 31.3 mt -57.59 -41.86 80.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 31.2 t -67.96 -31.23 51.11 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 CA-C-O 119.021 -0.514 . . . . 0.0 111.736 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -67.08 -62.22 4.62 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 119.132 0.878 . . . . 0.0 111.001 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.3 m -51.63 -22.27 3.24 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 116.9 0.35 . . . . 0.0 111.405 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 tp -57.46 -32.85 67.36 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.127 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.2 pt -73.63 -24.86 20.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.392 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.81 -55.13 30.22 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.865 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 2.1 tt -56.83 -31.96 65.26 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 117.044 0.422 . . . . 0.0 111.945 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -50.57 -34.34 25.34 Favored 'General case' 0 C--O 1.212 -0.885 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.66 -40.43 75.33 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 CA-C-O 118.688 -0.673 . . . . 0.0 112.427 -175.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 7.8 p -55.92 -29.2 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 CA-C-N 119.502 1.046 . . . . 0.0 111.185 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -56.71 -34.42 67.45 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.722 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.72 -35.25 63.47 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 119.294 -0.384 . . . . 0.0 111.573 -176.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.68 -32.16 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 120.001 -0.68 . . . . 0.0 109.836 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.26 -28.8 67.06 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.496 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.0 t -63.48 -38.41 91.04 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.364 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 15.0 tp -54.9 -30.98 59.59 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.083 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 41.3 t -75.44 -26.44 18.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.41 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -60.65 -16.93 43.99 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 707' ' ' ARG . . . . . 0.44 ' CZ ' ' CZ ' ' A' ' 707' ' ' ARG . 6.7 ptm180 -74.94 -32.38 61.73 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.276 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 35.4 t -82.79 -30.1 8.69 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.187 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 11.5 tpt85 . . . . . 0 CA--C 1.549 0.916 0 CA-C-O 119.264 -0.398 . . . . 0.0 111.958 179.376 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 12.1 tp -171.22 144.93 2.12 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.339 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -161.59 148.85 14.6 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.261 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.73 -19.73 6.89 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.584 179.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -75.1 -37.56 61.45 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.314 178.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -68.94 -39.6 79.48 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.784 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 75.4 m95 -68.24 -49.74 58.65 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.263 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.42 -40.58 77.17 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.128 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 26.1 t -60.93 -35.69 77.37 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.846 178.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 6.6 mt -57.58 -19.88 28.62 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.331 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -68.64 -2.84 9.99 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -64.24 -48.94 73.89 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.37 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.6 -23.12 13.51 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.409 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 54.37 1.71 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -63.92 -53.53 48.9 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 119.217 0.917 . . . . 0.0 111.722 -179.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 8.8 tp -69.28 -32.11 52.35 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.27 178.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 18.5 m -58.5 -39.13 79.2 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.951 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -60.35 -41.17 93.06 Favored 'General case' 0 C--O 1.211 -0.923 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 76.5 t90 -71.97 -22.16 61.48 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.974 178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.96 -16.46 35.75 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.69 26.44 5.59 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 119.963 -0.695 . . . . 0.0 112.329 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -130.37 -41.14 1.24 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 10.6 tt -66.53 -36.97 78.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.999 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -48.38 76.78 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 36.9 mt -60.19 -37.45 73.43 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.899 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -28.71 18.72 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.861 -178.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.68 -50.52 78.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.948 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 58.1 mt -58.22 -42.01 82.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.592 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 88.5 mt -58.88 -41.17 82.1 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 92.3 t -67.37 -17.96 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.018 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.13 -65.04 3.54 Favored Glycine 0 C--N 1.35 1.328 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 178.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 48.7 m -54.51 -29.51 50.63 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.772 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.9 tp -55.75 -41.77 74.45 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.926 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -71.03 -37.08 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.114 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.73 -40.6 98.68 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 110.124 -1.191 . . . . 0.0 110.124 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 3.2 tt -56.44 -31.66 64.15 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-O 120.655 0.265 . . . . 0.0 111.549 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 42.1 mmt-85 -50.45 -34.56 25.2 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 2.4 pp -57.48 -40.38 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -175.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 18.9 m -55.81 -28.33 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 119.263 -0.975 . . . . 0.0 110.965 -178.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -55.65 -36.27 66.85 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.038 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.85 -47.64 79.9 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 63.1 t -66.04 -44.54 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.8 tt -62.85 -29.51 70.8 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.928 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 35.4 t -64.41 -42.66 95.96 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.9 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.6 tp -80.1 -30.03 39.11 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.072 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.77 -22.67 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -60.72 -24.68 65.86 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.665 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -73.7 -11.59 60.45 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.038 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 61.9 t -107.34 -36.13 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 53.6 ttm-85 -127.91 145.62 50.89 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.65 -179.836 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 N--CA 1.497 1.914 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -162.84 150.61 13.66 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -167.44 -175.87 3.02 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.442 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 10.6 tt -53.55 -40.14 65.3 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.501 -179.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -74.35 -30.63 62.09 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.481 0.488 . . . . 0.0 112.044 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 5.4 tptp -70.37 -46.36 64.23 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -66.92 -39.64 87.42 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.366 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.25 -23.36 67.03 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.742 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -31.97 73.21 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.533 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 61.1 mt -77.45 -4.22 44.33 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 10.7 m0 -68.62 -5.19 18.63 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -89.11 -49.78 6.55 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 119.208 -0.997 . . . . 0.0 111.238 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . 0.423 ' O ' ' N ' ' B' ' 674' ' ' ASP . 1.2 p90 -104.27 -23.62 13.21 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.918 177.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 53.6 p90 34.5 25.73 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.401 1.259 . . . . 0.0 114.401 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' B' ' 672' ' ' TRP . 72.5 m-20 -63.65 -53.08 56.98 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 119.786 -0.765 . . . . 0.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tp -69.1 -31.58 50.72 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.05 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.1 m -58.8 -36.4 74.4 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.681 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -60.49 -45.9 92.06 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.595 -0.442 . . . . 0.0 109.817 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -70.83 -45.97 63.58 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.534 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 75.6 mt -67.35 -2.79 6.66 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 119.939 -0.704 . . . . 0.0 111.795 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.3 t90 -117.69 142.78 46.85 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 72.6 13.27 5.34 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -36.35 61.16 Favored 'Isoleucine or valine' 0 C--N 1.354 0.764 0 CA-C-N 119.585 1.084 . . . . 0.0 110.419 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.8 mtm105 -55.43 -43.76 75.65 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.904 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 88.2 mt -60.45 -42.75 92.28 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.753 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -55.81 -43.78 77.24 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.32 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.75 -40.52 82.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 120.267 -0.573 . . . . 0.0 109.644 179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 90.8 mt -58.77 -41.53 82.83 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.482 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 26.0 mm -58.75 -43.94 89.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 61.3 t -68.45 -9.51 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.161 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -78.08 -39.1 24.55 Favored Glycine 0 C--N 1.351 1.389 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 16.5 m -80.9 -19.83 43.49 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.802 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.82 -40.93 94.58 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.901 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -60.19 -40.4 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.579 -179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -68.3 -43.66 78.3 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 119.566 -1.302 . . . . 0.0 111.238 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.92 -38.54 73.02 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 116.906 0.353 . . . . 0.0 111.481 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 25.4 mmt180 -50.77 -30.17 13.4 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 44.8 mm -58.24 -39.85 75.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 119.435 -0.317 . . . . 0.0 111.225 -176.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 6.4 p -54.97 -26.95 18.33 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 C-N-CA 120.614 -0.435 . . . . 0.0 111.007 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -54.29 -24.8 20.41 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.57 -34.9 18.93 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 121.337 -0.145 . . . . 0.0 111.092 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 35.2 m -59.33 -31.34 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.55 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.9 tt -58.24 -41.62 84.58 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.592 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 26.7 t -64.82 -37.55 87.99 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -55.28 -43.98 75.26 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -176.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 27.1 m -71.1 -10.8 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 120.022 -0.671 . . . . 0.0 112.676 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.58 -14.05 17.81 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 119.427 -0.909 . . . . 0.0 110.84 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -73.95 -24.04 59.59 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 121.281 -0.167 . . . . 0.0 111.171 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 40.2 t -85.28 -36.07 10.58 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.275 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -68.64 -176.38 0.8 Allowed 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.498 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 118.004 -0.998 . . . . 0.0 111.067 179.855 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 17.7 mt . . . . . 0 N--CA 1.494 1.757 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -85.12 121.87 28.51 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.152 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -162.42 161.43 27.24 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.382 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 8.8 tt -52.91 -40.5 63.62 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.133 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -62.98 -31.87 73.08 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 123.834 0.709 . . . . 0.0 111.616 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -69.79 -41.17 75.44 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.047 -179.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -61.92 -49.33 76.61 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.449 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.54 -31.87 72.86 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.431 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 7.6 t -67.88 -32.68 73.33 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.604 0.24 . . . . 0.0 111.184 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 11.2 tp -57.66 -15.86 8.93 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.284 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -68.7 -2.61 9.63 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 118.981 -0.533 . . . . 0.0 112.35 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -65.03 -50.39 66.45 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 119.318 -0.953 . . . . 0.0 112.995 -177.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 12.9 p-90 -103.81 6.17 36.45 Favored 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 56.6 -29.39 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 118.943 2.942 . . . . 0.0 118.943 175.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.61 -54.6 33.38 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 121.519 1.963 . . . . 0.0 113.336 -175.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 1.6 mm -69.75 -27.77 34.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 119.119 -1.032 . . . . 0.0 110.113 177.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 18.8 m -58.55 -49.82 76.03 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -70.15 -42.79 72.08 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -178.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -69.19 -26.48 64.86 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -69.69 -32.93 71.82 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -126.58 18.43 7.44 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 114.495 1.295 . . . . 0.0 114.495 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -125.28 0.27 7.73 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.98 177.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 7.0 tp -68.56 -36.16 73.42 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 120.599 0.237 . . . . 0.0 111.524 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.07 -37.14 66.38 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.026 -0.533 . . . . 0.0 112.125 -176.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -63.95 -48.66 85.11 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.828 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -59.22 -30.13 68.02 Favored 'General case' 0 C--O 1.218 -0.575 0 O-C-N 123.387 0.429 . . . . 0.0 111.093 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.89 -46.0 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.116 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 63.8 mt -60.17 -41.68 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.823 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 3.5 mp -57.05 -40.89 75.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 51.2 t -66.95 -17.6 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 119.844 -0.742 . . . . 0.0 111.431 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -70.32 -62.8 3.52 Favored Glycine 0 C--N 1.351 1.384 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.05 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 4.5 m -51.85 -25.39 7.77 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 117.365 0.583 . . . . 0.0 112.01 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.4 tp -53.77 -34.3 58.62 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.001 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.7 pp -79.18 -33.32 15.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.787 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.937 179.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.92 -48.54 85.11 Favored Glycine 0 CA--C 1.543 1.795 0 C-N-CA 120.68 -0.771 . . . . 0.0 111.691 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -56.57 -31.84 64.62 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.5 -34.19 24.17 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 20.0 tt -57.64 -41.22 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-O 118.639 -0.696 . . . . 0.0 112.681 -174.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 5.6 p -56.49 -28.87 27.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.028 179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -34.84 69.7 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.303 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.75 -34.83 63.05 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -175.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 35.4 m -59.15 -31.24 45.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.459 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tt -58.64 -27.89 65.15 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.834 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 19.6 m -58.43 -38.33 77.21 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.497 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 14.2 tp -59.43 -35.23 73.64 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.441 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 9.9 t -84.9 -17.87 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.289 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.24 -25.92 66.02 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 34.2 mtm105 -73.85 -45.78 48.99 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.96 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 45.3 t -88.61 -12.59 10.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.254 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.79 163.98 0.05 Allowed 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.691 179.884 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.842 0 CA-C-O 119.695 -0.193 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 7.6 mp 55.88 177.87 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.527 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -169.92 147.7 3.36 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.269 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.1 tt -61.65 -40.24 94.21 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.528 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -73.98 -23.95 59.54 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.491 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 15.2 tmtt? -64.88 -42.16 95.03 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 121.059 -0.257 . . . . 0.0 111.136 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 91.5 m95 -69.1 -53.27 21.15 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.328 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.55 84.89 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.875 -178.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 40.4 t -58.75 -31.77 68.63 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.743 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 47.7 tp -58.73 -25.68 63.19 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.306 -178.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -68.29 -5.55 19.18 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 119.045 -1.062 . . . . 0.0 111.429 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -63.1 -40.31 97.27 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.972 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 6.5 m95 -83.42 -22.75 32.59 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.591 -178.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 42.9 t80 64.99 -67.25 0.12 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -56.04 -52.73 63.2 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -68.58 -28.42 40.13 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.767 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.477 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.0 m -58.97 -46.39 88.18 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.882 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -62.35 -47.38 84.48 Favored 'General case' 0 C--O 1.213 -0.824 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.737 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -64.88 -37.46 87.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.784 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 8.5 tp -67.98 -8.86 40.88 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.3 t-105 -139.3 0.86 1.94 Allowed 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -102.5 0.42 33.59 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 119.889 -0.724 . . . . 0.0 112.125 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.8 pp -55.93 -36.84 45.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.628 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.283 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -67.48 -48.51 66.93 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.946 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 86.3 mt -62.74 -43.67 98.87 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.921 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -52.81 -29.07 25.52 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.781 -179.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 16.9 mm -58.69 -38.97 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.923 -179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 10.8 mt -58.01 -41.75 81.08 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 80.8 mt -56.99 -41.28 77.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 177.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 43.3 t -68.04 -0.35 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.345 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -81.1 -34.92 25.42 Favored Glycine 0 C--N 1.349 1.272 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 178.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 13.3 m -75.81 -30.74 59.14 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 116.889 0.345 . . . . 0.0 111.101 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.79 -33.12 54.97 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.944 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 1.7 pp -70.58 -37.23 69.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 120.101 -0.64 . . . . 0.0 110.033 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.81 -43.27 98.09 Favored Glycine 0 C--O 1.214 -1.095 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.7 -42.19 78.7 Favored 'General case' 0 C--O 1.211 -0.953 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.553 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -50.48 -35.25 28.24 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.18 -40.19 76.37 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.77 -177.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 13.2 m -55.82 -28.35 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 118.384 0.538 . . . . 0.0 110.829 -179.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -58.45 -36.54 73.84 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.651 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.9 -50.81 72.06 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.175 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 11.1 p -68.83 -32.08 53.29 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.18 178.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.0 tp -58.77 -27.36 64.91 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.223 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 48.3 t -58.0 -45.32 87.03 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.423 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.3 -40.97 97.02 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.92 -28.39 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.435 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -60.81 -14.8 24.03 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -39.72 63.84 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.435 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 28.5 t -105.54 10.43 9.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.532 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 66.54 -76.07 0.05 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 122.237 -0.29 . . . . 0.0 110.531 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.468 179.924 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 tt . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 54.13 90.61 0.03 OUTLIER 'General case' 0 C--O 1.22 -0.461 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.933 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -143.79 147.52 34.26 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.398 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -27.4 18.57 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.463 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -74.23 -40.62 62.3 Favored 'General case' 0 C--O 1.22 -0.487 0 O-C-N 123.275 0.359 . . . . 0.0 111.147 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -65.26 -46.09 81.91 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.393 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -64.92 -43.86 91.4 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 120.779 -0.369 . . . . 0.0 111.005 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.28 -31.0 72.04 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.311 -179.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 34.4 t -55.62 -31.45 62.29 Favored 'General case' 0 C--O 1.219 -0.502 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.892 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 11.2 mp -71.44 -8.77 56.01 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -74.17 -26.79 60.5 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -63.01 -43.8 97.77 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.563 -178.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.22 -23.17 13.64 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.699 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 14.6 t80 50.42 6.27 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 178.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -63.66 -53.84 45.1 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 119.578 1.081 . . . . 0.0 110.992 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 7.0 tp -69.67 -29.83 42.65 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.911 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.844 177.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 13.1 m -59.04 -41.24 87.37 Favored 'General case' 0 C--O 1.214 -0.809 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.716 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -62.64 -47.35 84.1 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.268 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 3.0 t90 -72.47 -45.48 59.34 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.369 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 8.3 tp -74.47 -29.38 61.42 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 19.1 t90 -86.77 -14.82 41.22 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 120.152 -0.619 . . . . 0.0 112.016 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -103.94 10.81 36.11 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.238 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 30.9 pt -62.64 -41.27 91.55 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.3 ttp-105 -63.69 -45.55 89.53 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.749 -0.381 . . . . 0.0 110.734 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.0 -40.08 82.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -53.38 -30.93 42.32 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.473 -179.229 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 22.5 mm -59.8 -50.06 81.48 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.136 -179.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 73.7 mt -62.12 -42.15 93.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 79.6 mt -60.8 -42.67 93.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 87.0 t -68.73 -1.67 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.405 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -105.84 6.71 41.02 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.624 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 38.6 m -88.7 -34.27 17.25 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 117.414 0.607 . . . . 0.0 111.583 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.07 -35.12 76.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.417 -178.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -33.54 57.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.956 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.05 -44.06 37.67 Favored Glycine 0 C--O 1.214 -1.103 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 178.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.75 -41.62 77.87 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 121.323 -0.151 . . . . 0.0 110.836 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 28.0 mmt180 -51.03 -31.3 17.93 Favored 'General case' 0 C--O 1.214 -0.773 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.53 -40.68 82.57 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.26 -177.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 54.0 t -56.04 -28.21 24.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 119.551 -0.261 . . . . 0.0 110.889 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -55.44 -26.82 44.27 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 120.023 -0.671 . . . . 0.0 111.276 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -53.12 -36.82 61.18 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 120.639 -0.424 . . . . 0.0 109.943 178.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.57 -43.15 98.13 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.534 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.7 tt -63.33 -40.69 98.01 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.578 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.4 t -60.36 -32.75 71.57 Favored 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.287 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.86 -40.19 94.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.86 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.76 -19.5 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.684 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -60.85 -17.72 51.78 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.718 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 8.6 tpp85 -73.9 -41.43 62.13 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 46.1 t -92.21 -36.25 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.152 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 18.8 ttm105 -142.74 151.74 41.59 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.945 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.034 -0.984 . . . . 0.0 111.131 179.871 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.86 121.01 27.9 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.216 179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -161.25 162.64 31.18 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.079 -179.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 9.3 tt -58.03 -40.03 79.84 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.538 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -74.01 -23.95 59.51 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.511 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -44.36 76.08 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.232 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 86.5 m95 -62.67 -49.98 72.98 Favored 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 120.671 -0.412 . . . . 0.0 111.087 -179.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.0 -30.56 59.7 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.509 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.8 m -61.59 -32.32 72.42 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.454 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -67.32 -8.83 35.42 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -68.63 -22.39 64.42 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.758 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.09 -42.65 99.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 2.6 m95 -80.02 -22.75 42.06 Favored 'General case' 0 CA--C 1.558 1.269 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 63.27 -69.4 0.07 Allowed 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 120.068 1.304 . . . . 0.0 114.204 178.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -50.9 -52.37 42.55 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -176.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 7.3 tp -68.56 -28.49 40.44 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.006 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.6 m -58.81 -43.76 90.64 Favored 'General case' 0 C--O 1.22 -0.475 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.167 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -60.36 -47.02 87.84 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 120.326 -0.549 . . . . 0.0 109.8 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 41.8 t90 -57.55 -41.34 80.81 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.135 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 53.4 mt -73.62 -19.67 60.8 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -112.57 1.8 15.97 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -120.74 -7.9 9.53 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.542 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 8.0 tp -58.51 -36.62 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.998 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 49.3 ttp180 -55.8 -48.2 75.8 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.455 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -67.77 -46.75 81.85 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.572 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -52.74 -30.03 30.3 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 123.248 0.343 . . . . 0.0 111.067 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.82 -45.79 91.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 52.7 mt -62.74 -41.65 93.21 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 2.1 mp -56.49 -40.89 70.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 87.2 t -66.81 -22.17 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.899 -176.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.02 -5.43 87.66 Favored Glycine 0 CA--C 1.555 2.568 0 CA-C-N 119.93 1.241 . . . . 0.0 113.34 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 67.4 m -88.76 -34.5 17.1 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.97 1.385 . . . . 0.0 113.046 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.85 -31.68 50.39 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.049 -178.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -33.87 60.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.73 -37.14 89.3 Favored Glycine 0 CA--C 1.54 1.626 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 4.1 tt -56.39 -30.85 63.25 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -179.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -49.42 -36.3 21.78 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 2.2 pp -59.89 -41.92 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.964 0.802 . . . . 0.0 112.609 -177.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -28.85 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 118.523 -1.271 . . . . 0.0 110.282 -179.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -35.54 81.26 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -179.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.68 -35.48 66.08 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -176.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 34.1 m -59.77 -31.52 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 120.063 -0.655 . . . . 0.0 111.515 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.5 pp -58.47 -28.77 65.63 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.178 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.3 m -58.04 -41.42 83.22 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.337 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 24.9 tp -62.23 -33.56 74.82 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 23.0 t -69.87 -27.25 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.609 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -60.94 -7.01 2.11 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 64.0 ttt-85 -73.81 -42.51 60.81 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 3.1 t -102.68 26.08 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.673 179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.54 -78.4 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.694 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.463 179.801 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 45.9 mt . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.34 -155.93 0.2 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.083 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 78.25 168.6 0.21 Allowed 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 117.961 0.346 . . . . 0.0 110.706 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 3.4 tt -52.3 -22.57 4.64 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.204 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -69.47 -45.54 68.77 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.322 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -70.4 -41.33 73.15 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.7 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 77.2 m95 -64.56 -38.8 92.27 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.116 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.33 78.82 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 120.293 -0.563 . . . . 0.0 112.487 -178.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 11.5 t -57.39 -32.6 66.98 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.144 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 15.3 tp -58.76 -23.1 59.47 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.177 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -79.22 -2.99 43.62 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 118.274 -0.87 . . . . 0.0 112.954 -177.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.23 -50.68 37.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 117.987 -1.485 . . . . 0.0 111.906 -177.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -104.9 -22.13 13.2 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-O 120.714 0.292 . . . . 0.0 110.546 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 47.9 p90 40.22 23.28 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 178.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -62.81 -52.68 62.23 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.51 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.4 tp -68.59 -27.35 35.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.685 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 25.8 m -58.03 -36.15 72.32 Favored 'General case' 0 C--N 1.347 0.483 0 C-N-CA 120.367 -0.533 . . . . 0.0 109.719 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -59.94 -47.5 85.56 Favored 'General case' 0 C--O 1.219 -0.5 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 177.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 76.6 t90 -61.73 -19.86 62.88 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.224 177.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.5 tp -94.03 -8.5 39.68 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 120.362 -0.535 . . . . 0.0 112.011 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -128.33 21.38 6.16 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 120.367 -0.533 . . . . 0.0 112.123 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -132.41 -40.24 1.0 Allowed 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 178.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.07 -38.77 80.34 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.744 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -59.28 -48.17 82.61 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.528 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -62.06 -45.61 98.35 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -52.72 -27.56 18.15 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 32.7 mm -57.33 -50.52 76.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 C-N-CA 120.161 -0.616 . . . . 0.0 110.581 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 44.0 mt -58.94 -42.03 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 119.614 -0.834 . . . . 0.0 109.854 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 81.8 mt -56.65 -40.91 72.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.483 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 88.8 t -67.25 -16.02 20.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.864 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -72.32 -26.4 72.11 Favored Glycine 0 CA--C 1.539 1.542 0 N-CA-C 110.087 -1.205 . . . . 0.0 110.087 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -86.33 -19.84 29.22 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.671 0.236 . . . . 0.0 111.094 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.39 -40.9 88.08 Favored 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.266 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -68.53 -33.89 62.48 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.185 179.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -68.0 -43.22 82.92 Favored Glycine 0 C--O 1.213 -1.203 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 4.5 tt -55.96 -31.45 62.99 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-O 121.071 0.462 . . . . 0.0 110.697 178.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 2.7 tpp180 -50.34 -35.28 27.09 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.35 -40.49 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 10.8 m -55.79 -28.02 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 119.5 -0.88 . . . . 0.0 111.204 -177.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -55.28 -36.82 66.55 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.644 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.1 -48.92 77.44 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 88.4 t -65.65 -39.73 85.82 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 7.2 tt -60.9 -33.1 72.6 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.701 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 21.7 t -64.29 -45.22 88.96 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.208 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 16.5 tp -81.23 -34.09 32.4 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 1.8 p -60.87 -18.67 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.697 -178.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -66.26 -12.51 56.76 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 -73.78 -38.58 64.61 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.381 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 2.8 m -95.87 23.53 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.135 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 29.6 ttm180 -96.94 -59.16 1.86 Allowed 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 117.825 -1.084 . . . . 0.0 110.095 179.842 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 6.7 mp -125.64 92.33 3.58 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.217 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -140.09 160.89 38.93 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.295 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.73 -39.94 68.77 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.688 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -72.63 -32.23 65.75 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.848 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -46.2 64.62 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -72.81 -32.53 65.6 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.383 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.77 -38.12 79.83 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.676 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 26.5 t -59.63 -32.39 70.39 Favored 'General case' 0 C--O 1.218 -0.602 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.817 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 7.9 mt -57.57 -19.41 25.39 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.94 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -68.69 -2.88 10.22 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 119.909 -0.716 . . . . 0.0 112.511 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -81.39 -49.43 10.67 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.918 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.1 p90 -104.23 -23.08 13.29 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.516 177.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 49.7 p90 38.05 25.33 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 178.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -63.63 -53.59 49.02 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.606 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 5.8 tp -69.17 -41.22 81.26 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.394 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.2 m -59.01 -50.57 73.58 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.586 -178.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.52 -33.39 75.81 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 120.061 -0.655 . . . . 0.0 111.029 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . 0.422 ' O ' HG12 ' B' ' 682' ' ' ILE . 15.1 t-105 -72.13 -47.12 53.45 Favored 'General case' 0 C--O 1.209 -1.058 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.43 -17.14 35.07 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -176.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 4.2 t90 -69.49 0.72 4.83 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.718 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -126.71 -17.19 5.06 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . 0.422 HG12 ' O ' ' B' ' 678' ' ' TRP . 49.3 mm -59.34 -46.21 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 119.113 -0.47 . . . . 0.0 112.049 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 7.4 ptt-85 -56.51 -44.04 80.35 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.222 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 86.4 mt -67.73 -42.92 86.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -53.26 -28.18 26.31 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.989 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 29.9 mm -58.15 -49.7 80.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 C-N-CA 120.864 -0.335 . . . . 0.0 111.132 -178.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 49.9 mt -57.57 -41.73 79.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.1 -42.06 82.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.204 179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 57.4 t -68.61 -3.04 2.29 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.17 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.013 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.92 -36.83 10.79 Favored Glycine 0 C--N 1.346 1.096 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.54 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 71.0 m -75.09 -27.04 59.73 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 117.077 0.439 . . . . 0.0 111.045 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 mp -53.5 -32.22 49.41 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.982 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 1.6 pp -74.7 -38.17 44.35 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.712 0 C-N-CA 119.886 -0.725 . . . . 0.0 111.155 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.47 -55.24 28.57 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.584 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . 0.431 ' CD2' ' C ' ' B' ' 695' ' ' LEU . 0.0 OUTLIER -56.56 -28.32 59.9 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 117.298 0.549 . . . . 0.0 111.988 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -46.68 -28.49 1.5 Allowed 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 123.022 0.529 . . . . 0.0 112.089 -177.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 6.9 tp -57.33 -39.17 66.31 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.217 0 CA-C-O 118.958 -0.544 . . . . 0.0 111.553 -177.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 28.7 m -54.88 -28.28 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-N 119.124 0.875 . . . . 0.0 111.548 -178.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -55.21 -25.8 35.34 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -50.5 -50.16 53.63 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.503 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 31.0 m -68.03 -32.06 54.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.646 179.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.1 tt -63.46 -26.97 68.97 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.586 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 40.2 m -63.29 -34.49 77.8 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.285 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 20.0 tp -61.83 -43.19 99.34 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.109 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 81.3 t -65.45 -10.93 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.124 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -76.82 -21.65 54.76 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.633 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.46 -38.97 16.78 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 121.367 -0.133 . . . . 0.0 111.019 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 11.4 p -88.15 25.55 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.301 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 46.7 ttt85 -60.07 138.78 57.8 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.503 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.705 -179.866 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 N--CA 1.493 1.721 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -48.88 134.92 16.18 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.951 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -168.55 151.84 5.49 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.081 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.67 -29.18 62.06 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.264 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -74.17 -27.19 60.71 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.677 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.89 -39.25 76.37 Favored 'General case' 0 C--O 1.219 -0.535 0 O-C-N 123.355 0.409 . . . . 0.0 110.812 -179.282 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.8 m95 -63.69 -52.16 61.84 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.4 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -51.89 -34.34 40.84 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 37.4 m -59.12 -34.41 72.01 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.944 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 10.8 mp -78.07 -9.71 59.27 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 11.7 m0 -68.66 -26.24 65.21 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.115 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -62.78 -42.61 99.78 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -79.58 -22.17 44.09 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -177.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 69.08 -44.2 0.53 Allowed 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.895 1.225 . . . . 0.0 113.063 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -57.56 -52.8 63.93 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 118.431 0.56 . . . . 0.0 111.585 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.61 -30.34 46.95 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.531 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.2 m -58.73 -45.24 90.08 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.577 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -78.42 -22.37 47.85 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.932 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -56.37 -22.12 29.15 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.143 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.27 -33.15 13.35 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.903 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -97.89 24.37 7.0 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.632 -179.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -133.03 -39.4 0.95 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . 0.436 HG21 HD13 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -61.15 -45.62 98.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.51 0 CA-C-N 116.325 -0.398 . . . . 0.0 109.99 178.498 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 30.8 ttp180 -59.29 -46.71 87.82 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 121.237 0.541 . . . . 0.0 110.257 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 80.0 mt -67.88 -36.47 75.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.468 179.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.41 -28.98 14.33 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -175.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 2.2 mp -60.03 -39.98 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 119.474 -0.891 . . . . 0.0 109.059 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 46.5 mt -58.72 -41.51 82.61 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 34.3 mm -59.8 -44.15 93.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.526 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 53.6 t -68.18 -24.15 29.62 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.118 0 CA-C-O 118.924 -0.56 . . . . 0.0 112.149 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.6 -61.23 7.72 Favored Glycine 0 C--N 1.354 1.535 0 N-CA-C 110.149 -1.181 . . . . 0.0 110.149 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 45.4 m -57.33 -31.52 65.78 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.585 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -60.8 -47.17 87.54 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.676 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -73.09 -34.34 44.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 119.986 -0.685 . . . . 0.0 109.959 179.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.82 -43.4 96.59 Favored Glycine 0 CA--C 1.54 1.628 0 C-N-CA 120.665 -0.778 . . . . 0.0 111.335 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.22 -31.29 63.36 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 117.004 0.402 . . . . 0.0 110.572 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 21.6 mmm180 -49.81 -34.69 20.32 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.89 -40.12 74.73 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -175.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 8.7 p -54.9 -28.43 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.148 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -60.32 -35.68 76.19 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.05 -39.08 71.48 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.817 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 86.2 t -62.49 -31.86 53.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.115 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 12.7 tp -58.69 -37.03 75.19 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.452 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 10.3 p -57.83 -35.56 71.05 Favored 'General case' 0 C--O 1.219 -0.521 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.844 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.6 tp -58.86 -37.04 75.63 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.811 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 16.3 t -76.28 -16.23 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.201 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -63.12 -28.87 70.36 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 48.2 ptt85 -86.42 -37.36 18.42 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.314 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 33.6 m -90.95 -1.76 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.276 0.472 . . . . 0.0 112.276 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 12.9 mmp_? 54.55 178.72 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.718 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.597 179.992 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 34.0 mt -74.78 177.92 5.85 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -169.75 168.94 8.73 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.417 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 8.9 tt -61.59 -40.14 93.72 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.671 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.19 -24.43 62.23 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.738 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -66.54 -46.03 77.48 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.244 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -73.19 -51.96 15.89 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.21 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.38 -22.63 54.49 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.772 -179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 13.6 t -60.41 -32.58 71.48 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.298 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -71.4 -14.22 62.1 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.41 -0.516 . . . . 0.0 112.061 -179.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -68.97 -12.69 61.9 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.95 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -62.65 -48.23 80.22 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.231 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.71 -22.61 15.32 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.094 179.409 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 9.7 t80 59.02 -0.34 0.14 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -63.53 -53.03 58.26 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 118.894 0.77 . . . . 0.0 110.867 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.05 -31.61 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.826 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.3 m -58.69 -44.95 90.44 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.76 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -60.64 -41.55 95.16 Favored 'General case' 0 C--O 1.215 -0.721 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.589 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 11.1 t90 -71.17 -27.66 63.69 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.375 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.5 -15.15 31.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -111.13 -5.26 14.78 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -118.42 -11.11 10.03 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.569 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 15.3 tt -66.83 -38.91 82.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.748 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -56.48 -48.33 77.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 120.056 -0.657 . . . . 0.0 109.436 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 82.0 mt -63.7 -46.88 93.45 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -29.09 24.43 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.36 -43.34 86.16 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.191 -179.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 46.7 mt -58.68 -41.45 82.35 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.259 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 42.5 mm -56.28 -41.31 70.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 46.3 t -68.09 -0.27 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 120.531 -0.467 . . . . 0.0 111.411 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -99.24 -31.94 5.99 Favored Glycine 0 CA--C 1.535 1.329 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.1 m -73.72 -16.86 61.18 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.853 0.327 . . . . 0.0 111.232 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.0 -40.14 80.02 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.224 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -70.61 -35.42 61.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.368 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.67 -47.78 83.51 Favored Glycine 0 C--N 1.347 1.159 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 4.6 tt -56.13 -31.68 63.55 Favored 'General case' 0 C--O 1.21 -1.013 0 CA-C-O 121.032 0.444 . . . . 0.0 110.793 179.208 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -50.52 -34.82 26.77 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.5 tp -58.04 -40.07 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -175.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 17.4 m -55.27 -28.04 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 118.807 0.73 . . . . 0.0 110.696 -178.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -55.76 -36.38 67.26 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.43 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.66 -50.51 73.58 Favored 'General case' 0 C--O 1.219 -0.536 0 O-C-N 123.291 0.369 . . . . 0.0 111.064 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 9.0 p -68.16 -33.99 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 120.491 -0.484 . . . . 0.0 109.939 179.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.58 -36.99 83.99 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 178.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 66.8 m -64.4 -43.93 92.9 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.394 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 11.4 tp -81.01 -17.46 50.23 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 2.5 p -60.89 -29.24 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.226 -178.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -61.91 -11.12 11.48 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 52.5 ttt85 -73.68 -35.3 65.18 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 121.112 -0.235 . . . . 0.0 110.795 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 47.3 t -102.44 -36.19 4.33 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.531 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.18 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -162.39 154.7 19.14 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.899 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.105 -0.95 . . . . 0.0 110.83 179.972 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 12.5 tp . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 55.0 mt -135.93 149.49 48.95 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.358 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -178.6 174.47 1.2 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.3 -15.07 8.86 Favored 'General case' 0 C--O 1.211 -0.967 0 C-N-CA 119.041 -1.063 . . . . 0.0 111.06 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -66.25 -39.72 89.68 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -70.67 -46.42 63.22 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.743 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . 0.452 ' O ' ' HG ' ' B' ' 669' ' ' LEU . 77.0 m95 -73.19 -30.64 63.69 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -81.52 -10.74 59.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.542 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 5.7 t -75.23 -32.58 61.17 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 121.147 -0.221 . . . . 0.0 110.86 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' B' ' 666' ' ' TRP . 0.0 OUTLIER -65.29 -12.61 53.44 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.686 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 14.1 m95 -68.22 -19.41 64.74 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.112 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -89.46 -47.95 7.65 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 6.1 p-90 -103.16 -23.51 13.64 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 -177.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 51.15 -3.45 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 116.228 1.936 . . . . 0.0 116.228 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -53.27 55.69 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 120.217 1.371 . . . . 0.0 113.68 -177.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . 0.45 HD11 HG21 ' B' ' 675' ' ' ILE . 0.4 OUTLIER -68.32 -27.93 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 119.639 -0.825 . . . . 0.0 110.755 -179.688 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.3 m -59.11 -50.06 75.49 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.105 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -69.03 -20.95 64.14 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.542 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 8.2 t90 -72.19 -46.86 54.55 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.43 -10.45 32.42 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -92.55 -15.44 26.97 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 119.886 -0.725 . . . . 0.0 112.226 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -114.04 -31.53 6.33 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.43 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 23.8 mm -65.59 -44.66 93.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-O 119.24 -0.41 . . . . 0.0 111.48 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -42.7 76.63 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.172 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 84.4 mt -68.7 -41.96 82.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -52.79 -28.86 24.38 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.024 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.4 mp -58.73 -37.61 67.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.5 mt -58.54 -41.87 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 2.7 mp -62.34 -41.28 91.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 47.2 t -67.86 -4.14 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.305 -179.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.46 -45.11 7.06 Favored Glycine 0 C--N 1.348 1.24 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 2.5 m -69.76 -22.9 63.31 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.856 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -54.34 -32.94 57.9 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.964 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 1.9 pp -65.2 -38.21 82.08 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.808 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.58 -51.73 49.43 Favored Glycine 0 C--O 1.213 -1.172 0 N-CA-C 111.15 -0.78 . . . . 0.0 111.15 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.72 -42.25 78.87 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -30.27 13.99 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 7.6 tp -58.63 -40.54 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -175.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 9.9 p -55.88 -28.03 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 118.306 0.503 . . . . 0.0 111.773 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -55.29 -26.98 43.71 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.275 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.77 -35.61 63.97 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.145 178.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 64.8 t -59.86 -32.73 50.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.926 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 1.1 pp -61.44 -30.79 70.8 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.296 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.6 t -58.1 -36.19 72.51 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.988 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.0 tp -63.93 -32.39 73.9 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.235 179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 21.4 t -83.08 -33.71 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 120.969 -0.293 . . . . 0.0 110.375 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -65.28 -34.32 78.07 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.579 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.57 -33.54 62.7 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.56 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 9.9 p -111.11 26.11 3.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.292 -179.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -49.35 111.21 0.46 Allowed 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.95 -0.3 . . . . 0.0 111.226 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.976 -179.888 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 3.4 mt -73.45 -172.01 1.1 Allowed 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -144.89 106.93 4.3 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.07 -33.12 68.71 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.359 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -60.55 -23.9 64.98 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.658 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 7.7 tmtt? -70.13 -41.68 73.6 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.15 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 76.2 m95 -73.05 -33.89 65.95 Favored 'General case' 0 C--O 1.214 -0.803 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.041 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -83.2 -30.75 27.51 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.013 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 3.3 p -56.23 -30.92 63.0 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.6 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -10.97 0.69 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -177.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -68.19 -31.1 70.39 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.451 -0.9 . . . . 0.0 109.915 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -83.29 -50.0 8.83 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 119.642 -0.823 . . . . 0.0 112.791 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 4.8 p-90 -97.94 -23.53 15.78 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 116.296 1.961 . . . . 0.0 116.296 -178.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 54.89 -7.38 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 121.453 1.933 . . . . 0.0 115.758 177.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -63.47 -53.06 58.04 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . 0.4 HD12 HG22 ' C' ' 675' ' ' ILE . 0.4 OUTLIER -69.08 -40.03 80.23 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 C-N-CA 118.88 -1.128 . . . . 0.0 112.617 -178.199 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 77.2 m -63.61 -33.78 76.37 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.926 -179.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -64.79 -47.09 79.36 Favored 'General case' 0 C--O 1.21 -0.995 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.113 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 2.5 t90 -72.31 -45.99 57.61 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.154 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.57 -32.86 68.54 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -110.37 62.29 0.6 Allowed 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -173.92 -33.99 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.231 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 16.3 pt -55.19 -36.89 41.39 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.723 0 CA-C-O 119.324 -0.369 . . . . 0.0 111.88 -178.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 10.9 mtp180 -56.69 -48.32 77.93 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.434 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 81.1 mt -67.56 -44.48 86.39 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.562 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.291 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -53.06 -28.45 24.81 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.907 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 14.8 mm -58.29 -40.11 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 120.023 -0.671 . . . . 0.0 110.098 -178.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.5 mt -59.78 -42.11 87.76 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.601 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 66.6 mt -65.1 -41.44 91.86 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.129 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 96.2 t -67.48 -22.34 28.61 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.171 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.872 -176.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.01 -4.13 90.36 Favored Glycine 0 CA--C 1.55 2.251 0 CA-C-N 119.668 1.122 . . . . 0.0 113.665 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 43.3 m -88.82 -34.7 16.95 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.76 1.28 . . . . 0.0 113.223 -178.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . 0.404 ' CD1' ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -64.79 -31.75 73.12 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.073 -178.775 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . 0.404 ' N ' ' CD1' ' C' ' 692' ' ' LEU . 0.0 OUTLIER -69.03 -29.17 42.23 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 179.268 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.69 -40.85 95.38 Favored Glycine 0 CA--C 1.541 1.707 0 C-N-CA 120.193 -1.003 . . . . 0.0 110.97 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.3 tt -56.8 -34.08 67.31 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.27 -34.83 24.65 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.27 -40.69 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -175.469 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 8.2 p -56.02 -28.93 25.74 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.924 0 CA-C-N 119.187 0.903 . . . . 0.0 111.064 -178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.6 -35.45 70.45 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.759 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.7 -35.62 66.26 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -177.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.84 -31.47 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.799 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.4 pp -58.54 -25.52 62.56 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.943 -179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 74.2 m -57.85 -38.35 75.52 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.332 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.15 -39.14 85.31 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.8 t -69.91 -18.82 22.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.868 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -60.67 -16.65 41.36 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -73.87 -37.57 64.7 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.703 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 21.0 t -96.46 9.5 6.17 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.801 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 15.2 tpp85 63.44 138.77 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 O-C-N 122.267 -0.271 . . . . 0.0 110.874 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 C--O 1.219 -0.548 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.538 179.804 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . 0.414 H202 H181 ' C' ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 10.1 tt . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.5 tp -150.72 -54.72 0.15 Allowed 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.393 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 48.42 177.39 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.33 -38.59 58.99 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 114.254 -1.339 . . . . 0.0 111.588 -178.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -60.97 -41.81 97.09 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -177.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 23.7 mmtp -71.11 -44.51 65.5 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 118.869 -1.133 . . . . 0.0 112.497 -179.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -59.04 -39.2 81.26 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.955 -179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.23 -39.65 94.4 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.238 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 32.2 t -58.11 -32.68 68.34 Favored 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.557 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.7 -7.76 42.06 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.43 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 33.8 m0 -75.28 -6.75 51.44 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -62.57 -48.96 77.17 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.283 -179.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.72 -22.53 13.54 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 19.1 p90 49.67 -3.07 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -63.71 -53.55 49.38 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-N 120.355 1.434 . . . . 0.0 110.165 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 14.6 mm -69.43 -27.84 35.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.469 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 32.9 m -58.92 -48.63 80.79 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -64.92 -34.84 79.37 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 28.5 t90 -64.38 -19.91 65.79 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.765 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -84.96 -2.68 58.2 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 120.297 -0.561 . . . . 0.0 112.195 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 53.9 t-105 -145.16 -43.93 0.23 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 120.123 -0.631 . . . . 0.0 112.108 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -66.22 -13.08 59.76 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 13.7 pt -55.33 -36.15 39.39 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.721 0 C-N-CA 120.536 -0.465 . . . . 0.0 110.935 179.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -54.86 -32.77 61.08 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.894 -179.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 45.2 mm -59.69 -48.28 88.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.066 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -67.82 -28.2 67.37 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 29.2 mm -58.12 -43.16 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.451 0.569 . . . . 0.0 111.853 -177.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 63.4 mt -58.29 -41.88 82.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.024 -179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 47.5 mt -62.83 -41.49 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 60.5 t -68.21 -3.96 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -177.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -101.5 6.21 55.26 Favored Glycine 0 CA--C 1.543 1.794 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.846 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 14.6 m -88.31 -34.23 17.73 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 117.4 0.6 . . . . 0.0 111.781 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.0 -32.64 54.76 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.488 -178.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.75 -37.9 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.529 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.82 -36.82 74.91 Favored Glycine 0 C--O 1.212 -1.219 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.76 -36.44 69.79 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 86.6 mmt-85 -52.76 -35.94 57.15 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 2.3 pp -59.15 -41.82 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 9.2 p -64.88 -29.57 47.79 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.815 0 C-N-CA 118.889 -1.124 . . . . 0.0 111.272 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -55.8 -35.57 66.46 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 121.129 -0.228 . . . . 0.0 110.897 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.91 -35.6 66.77 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.978 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 1.7 p -59.91 -33.11 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.914 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.6 tt -65.86 -29.84 70.35 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.182 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 42.3 p -57.59 -47.42 82.15 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.698 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.52 -39.39 94.31 Favored 'General case' 0 C--O 1.215 -0.719 0 CA-C-N 116.34 -0.391 . . . . 0.0 109.95 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 73.8 t -60.85 -15.38 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -80.23 -12.63 59.61 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -73.82 -27.79 61.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 120.091 -0.644 . . . . 0.0 111.579 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 39.1 t -82.81 -36.08 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.438 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.94 179.14 5.05 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.396 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.848 -179.936 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -108.3 119.18 38.75 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.936 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -137.98 162.08 35.02 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.381 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 10.6 tt -59.18 -40.17 84.84 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.932 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -73.79 -25.32 60.07 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.913 -179.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -68.82 -46.15 69.36 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.783 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -64.52 -53.58 45.79 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 120.834 -0.347 . . . . 0.0 110.856 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.48 -23.13 56.99 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.116 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.92 -33.29 70.39 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.877 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 68.9 mt -65.03 -17.52 64.52 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -68.51 -2.9 9.79 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 120.612 -0.435 . . . . 0.0 112.002 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -73.32 -48.61 32.98 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.231 -0.588 . . . . 0.0 112.2 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . 0.413 ' C ' ' H ' ' B' ' 674' ' ' ASP . 0.0 OUTLIER -103.88 -23.17 13.4 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.82 179.898 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 42.8 t80 58.92 -12.25 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . 0.413 ' H ' ' C ' ' B' ' 672' ' ' TRP . 25.7 t0 -63.55 -52.56 60.58 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 119.345 0.975 . . . . 0.0 111.636 -179.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tp -68.46 -27.77 37.84 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.971 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.613 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 25.8 m -58.41 -41.77 85.71 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.405 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -45.56 92.15 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.827 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -72.14 -37.3 69.47 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.064 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.66 -3.09 42.31 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -120.37 -35.2 3.47 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 120.138 -0.625 . . . . 0.0 112.115 -178.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -66.52 -7.69 21.65 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.295 -0.562 . . . . 0.0 112.156 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . 0.44 HD12 HG21 ' B' ' 682' ' ' ILE . 0.2 OUTLIER -67.8 -46.27 82.72 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 119.926 -0.71 . . . . 0.0 112.535 -179.326 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 37.3 ptt180 -62.96 -42.8 99.93 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 118.58 0.627 . . . . 0.0 111.654 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 94.7 mt -65.7 -43.98 93.5 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -57.27 -34.18 68.39 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.22 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.72 -46.14 90.73 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 62.7 mt -58.65 -41.6 82.66 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.548 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 15.6 mm -59.64 -42.92 89.99 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.547 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 75.3 t -68.38 -15.74 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 CA-C-O 119.277 -0.392 . . . . 0.0 111.885 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -71.27 -54.18 9.36 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 44.1 m -64.44 -23.22 67.21 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.291 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.99 -32.77 55.09 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.565 -178.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 2.4 pp -65.3 -39.37 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.097 -178.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.18 -48.06 78.71 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.098 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.1 mt -56.83 -42.25 79.29 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 117.153 0.477 . . . . 0.0 111.9 -178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.48 -29.92 11.57 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 41.7 mm -58.44 -40.57 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 CA-C-O 119.023 -0.513 . . . . 0.0 111.679 -176.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 5.4 p -55.76 -28.16 23.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 118.652 0.66 . . . . 0.0 111.296 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -55.35 -26.84 43.37 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.346 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.66 54.23 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.006 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.99 -34.92 58.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.219 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.33 -35.23 73.44 Favored 'General case' 0 C--O 1.219 -0.522 0 O-C-N 123.007 0.192 . . . . 0.0 110.608 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.6 t -57.98 -31.85 67.31 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.855 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 6.9 tp -60.65 -42.5 97.11 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 61.1 t -73.69 -19.82 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -64.44 -8.63 14.2 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 28.2 mtt180 -73.96 -40.95 62.66 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.175 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 34.9 t -87.52 -36.19 9.34 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.784 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 -122.26 145.32 48.34 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.138 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 . . . . . 0 C--O 1.221 -0.424 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.683 -179.925 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 58.1 mt . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 2.1 tp -45.77 142.07 2.67 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 111.45 0.167 . . . . 0.0 111.45 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -169.7 165.69 9.97 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.197 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.09 -31.12 66.8 Favored 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.509 -179.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -74.22 -27.43 60.79 Favored 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -63.28 -42.31 99.08 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.321 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -58.74 -31.41 68.29 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.55 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.89 -16.17 6.25 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.513 178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 17.6 m -53.23 -32.96 50.86 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.45 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 11.9 tp -55.83 -13.44 1.78 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.841 179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -69.59 -43.44 72.79 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -177.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -88.78 -52.01 5.35 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 117.25 -1.78 . . . . 0.0 113.67 -177.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . 0.449 ' HE1' ' C18' ' C' ' 801' ' ' QOJ 0.258 6.0 p-90 -103.96 -21.96 13.55 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 178.142 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 2.2 t80 72.53 -27.77 0.19 Allowed 'General case' 0 C--N 1.373 1.622 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 175.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.26 -53.08 54.65 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -175.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 10.9 tp -69.76 -48.8 62.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 CA-C-N 120.946 1.703 . . . . 0.0 115.25 -176.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.8 m -61.27 -33.88 74.26 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 118.973 -1.091 . . . . 0.0 109.123 -178.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -62.84 -17.5 61.46 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.082 177.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 19.6 t90 -71.89 -44.66 63.37 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 7.5 mp -67.93 -2.77 8.07 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.596 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.35 168.85 18.16 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 78.49 -39.05 0.25 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.541 0.736 . . . . 0.0 110.711 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 1.7 mp -58.77 -36.8 62.54 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -55.83 -44.47 77.96 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.061 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 44.3 mt -68.33 -36.81 76.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.347 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -52.01 -30.21 24.3 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.07 -42.98 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 65.6 mt -58.84 -41.22 82.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 46.5 mm -56.8 -41.86 76.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.495 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 57.4 t -67.81 -31.51 52.55 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 119.904 -0.719 . . . . 0.0 111.358 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.09 -47.68 72.18 Favored Glycine 0 C--N 1.353 1.506 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.6 -33.98 76.88 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.169 178.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.2 tp -62.04 -57.06 13.05 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.612 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.96 -29.07 25.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.128 179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.24 -41.09 94.7 Favored Glycine 0 CA--C 1.541 1.695 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.54 -31.22 63.95 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 117.369 0.584 . . . . 0.0 111.223 179.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 -49.78 -35.24 21.86 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -178.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 6.9 tp -58.68 -40.92 80.84 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -175.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 16.4 m -55.91 -28.5 24.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 CA-C-N 119.305 0.957 . . . . 0.0 111.31 -178.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -55.63 -35.5 65.98 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.299 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.81 -39.02 70.76 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.015 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 75.2 t -68.05 -39.79 82.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.92 -28.8 66.57 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.512 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 23.4 p -59.92 -35.52 75.06 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.652 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.2 tp -59.11 -40.62 85.91 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 20.1 t -66.29 -19.8 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.594 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -60.76 -10.91 6.12 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 23.0 ptt85 -101.02 -12.76 18.62 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 55.9 t -82.86 -30.86 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.226 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 83.4 mtm-85 -54.37 124.99 17.68 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.27 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 . . . . . 0 C--O 1.219 -0.508 0 CA-C-O 117.912 -1.042 . . . . 0.0 110.811 179.844 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . 0.449 ' C18' ' HE1' ' C' ' 672' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 5.4 tp -67.11 -146.74 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -169.34 96.34 0.33 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.367 0.53 . . . . 0.0 110.919 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.9 tt -67.08 -40.43 87.01 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-O 120.929 0.395 . . . . 0.0 111.368 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -68.21 -23.5 64.83 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.248 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -67.26 -34.6 77.77 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.709 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -61.08 -35.74 77.79 Favored 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.512 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -92.37 -19.26 22.28 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.97 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 75.5 m -73.91 -37.34 64.68 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.044 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.4 pp -63.48 -9.06 11.05 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.889 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -68.34 -19.73 64.67 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.219 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -84.67 -48.13 9.78 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 4.5 p90 -100.95 -22.74 14.7 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 118.082 0.401 . . . . 0.0 111.967 -178.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 48.58 16.64 0.11 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -63.4 -54.03 43.13 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.18 -177.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -69.77 -31.32 47.96 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 C-N-CA 119.699 -0.8 . . . . 0.0 110.704 178.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 13.8 m -58.26 -33.84 69.84 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.459 -178.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -59.69 -44.05 93.8 Favored 'General case' 0 C--O 1.215 -0.753 0 C-N-CA 119.817 -0.753 . . . . 0.0 108.973 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -72.82 -46.09 54.94 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.451 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 14.1 mt -67.57 -2.87 7.34 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.7 m95 -133.23 142.51 48.6 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 92.12 -32.51 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.232 1.013 . . . . 0.0 111.277 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.7 pp -68.09 -41.23 84.13 Favored 'Isoleucine or valine' 0 C--N 1.35 0.624 0 C-N-CA 119.315 -0.954 . . . . 0.0 109.55 178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -69.28 -47.08 65.62 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.98 -37.43 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.734 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -52.19 -43.72 64.34 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.865 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.9 mp -58.73 -37.91 68.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.753 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 39.6 mm -58.04 -42.13 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 80.2 mt -59.86 -41.19 84.94 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 176.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 57.2 t -67.51 -25.41 33.15 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.593 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.76 -32.28 81.12 Favored Glycine 0 C--N 1.35 1.336 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.9 m -86.16 -31.82 21.59 Favored 'General case' 0 C--O 1.219 -0.529 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 5.2 tp -59.69 -44.63 93.58 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.009 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 4.1 tp -55.58 -35.85 39.88 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.988 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -72.61 -40.11 54.44 Favored Glycine 0 C--O 1.215 -1.078 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -56.8 -40.21 75.51 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 120.861 0.362 . . . . 0.0 110.886 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 40.4 mmt180 -53.31 -35.21 59.91 Favored 'General case' 0 C--O 1.214 -0.789 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 -179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.27 -40.69 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 120.451 -0.499 . . . . 0.0 112.008 -176.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 12.4 p -55.96 -28.26 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.021 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -55.41 -35.88 65.85 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.602 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.02 -35.71 67.15 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.435 -0.506 . . . . 0.0 109.763 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 92.6 t -65.77 -34.36 69.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 9.0 tp -60.28 -29.84 69.08 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.915 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 26.8 m -57.95 -45.52 86.51 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.657 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 15.0 tp -64.88 -39.99 94.42 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 78.0 t -69.73 -24.94 27.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.56 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -71.0 -31.38 67.89 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -23.11 58.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.843 -179.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 33.9 m -99.36 25.97 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 C-N-CA 120.534 -0.467 . . . . 0.0 111.259 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -51.09 70.85 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.357 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.83 179.741 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 9.8 tp . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 60.3 mt 61.13 123.61 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.344 0.403 . . . . 0.0 111.091 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -158.32 176.94 11.82 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.99 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.74 -39.52 88.99 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.486 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.09 -28.23 64.18 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.693 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -69.95 -46.02 66.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.741 -179.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -70.14 -37.58 75.29 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.591 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.32 -41.96 80.07 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.0 p -54.48 -31.5 55.93 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.475 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 13.0 tp -61.84 -10.5 9.33 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.918 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 37.8 m0 -68.4 -25.51 65.08 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.885 -0.726 . . . . 0.0 111.112 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -62.98 -46.29 88.41 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -23.91 13.6 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 120.009 -0.676 . . . . 0.0 111.447 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 72.7 t80 45.56 10.47 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -64.13 -54.7 29.66 Favored 'General case' 0 C--N 1.354 0.782 0 CA-C-N 119.74 1.155 . . . . 0.0 113.356 -177.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 9.2 tp -69.98 -27.58 33.27 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.914 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.838 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 9.4 m -58.71 -45.9 88.52 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.898 -178.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -61.81 -47.19 86.24 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.264 -0.575 . . . . 0.0 111.557 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -72.21 -42.04 66.21 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 -179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 7.9 tp -74.25 -33.01 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -177.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -96.28 23.95 6.19 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.204 -0.599 . . . . 0.0 112.326 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -137.9 11.47 2.88 Favored 'General case' 0 C--O 1.218 -0.583 0 C-N-CA 120.396 -0.521 . . . . 0.0 111.549 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 16.8 pt -65.05 -43.3 95.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 87.9 mtm-85 -59.69 -46.18 89.85 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.105 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -68.33 -39.22 80.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.132 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -62.27 -51.16 68.82 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 2.6 mp -65.14 -39.82 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.491 -178.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 80.4 mt -58.75 -41.71 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.855 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 55.3 mt -58.54 -41.63 82.41 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 61.2 t -67.79 -29.4 44.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.878 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.92 -43.33 96.82 Favored Glycine 0 C--N 1.35 1.351 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -34.09 73.81 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 3.7 tp -63.53 -43.38 97.3 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.944 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -66.13 -39.1 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.822 -179.138 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.81 -42.09 87.28 Favored Glycine 0 CA--C 1.531 1.045 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.15 -31.44 63.35 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 120.743 0.306 . . . . 0.0 110.31 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -50.71 -31.9 17.88 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 122.814 0.446 . . . . 0.0 111.896 179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 45.5 mt -60.17 -42.87 91.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.356 -177.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 44.2 t -57.0 -28.94 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.517 -178.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -25.41 39.91 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.215 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.72 -35.52 22.29 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 33.8 m -59.82 -32.03 48.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 120.07 -0.652 . . . . 0.0 110.668 -179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 20.0 tp -60.26 -38.3 83.09 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.799 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 6.4 t -57.93 -38.87 76.7 Favored 'General case' 0 C--O 1.22 -0.479 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.975 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.9 tp -65.78 -42.8 90.36 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.072 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 39.8 t -71.25 -23.72 23.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.601 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.69 -14.82 62.03 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.16 -30.97 17.28 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.531 -179.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 34.8 m -88.39 -25.61 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.492 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -96.79 140.04 31.95 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.742 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.758 179.944 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 23.1 tp . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 tp -143.49 113.39 7.15 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -146.09 163.76 34.28 Favored 'General case' 0 C--O 1.218 -0.582 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.744 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 10.5 mt -61.42 -38.78 88.35 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.851 179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.87 -28.62 62.61 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.534 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -70.23 -44.13 69.21 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.154 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -60.56 -57.05 14.37 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.368 179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.57 -47.02 77.09 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.146 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 78.6 p -60.2 -31.94 70.63 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 123.224 0.328 . . . . 0.0 111.179 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 11.9 tp -64.19 -4.64 3.82 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -68.27 -6.59 24.65 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.818 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -63.17 -37.06 85.73 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -79.84 -22.68 42.69 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -176.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 64.23 -71.42 0.07 Allowed 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.198 1.363 . . . . 0.0 112.462 178.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -50.84 -49.69 58.32 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 46.1 mm -65.96 -40.53 87.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.666 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.2 m -58.93 -49.82 76.38 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.146 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -67.74 -40.53 84.15 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.516 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -60.53 -36.84 79.38 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.531 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 5.9 tp -76.9 -14.25 59.9 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 3.3 t90 -111.16 -19.12 12.82 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -95.0 -38.25 10.75 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.626 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 47.5 mm -57.57 -36.9 55.67 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.512 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.659 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.7 -33.91 66.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.06 178.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -68.0 -41.58 84.67 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -56.25 -28.05 57.17 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.883 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 36.8 mm -58.2 -45.44 88.84 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.577 -177.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 41.1 mt -65.42 -40.79 89.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 21.2 mm -55.95 -41.13 66.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.496 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.734 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 61.3 t -67.12 -23.66 30.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 120.033 -0.667 . . . . 0.0 111.942 -178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -59.63 -51.35 59.55 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-N 119.189 0.904 . . . . 0.0 111.555 179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 2.0 m -72.72 -21.89 60.97 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 117.247 0.523 . . . . 0.0 112.181 -179.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.7 tp -55.95 -38.27 70.11 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.888 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -73.77 -23.03 18.89 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.579 -179.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.48 -47.43 89.91 Favored Glycine 0 CA--C 1.542 1.76 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.102 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.54 -30.69 63.37 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -49.65 -34.92 19.69 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -177.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 7.2 tp -58.17 -40.27 76.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -175.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.6 p -55.72 -28.55 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 CA-C-N 118.968 0.804 . . . . 0.0 111.449 -178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -55.65 -35.32 65.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.37 -35.97 65.85 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.318 -177.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 77.5 t -64.73 -31.66 54.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 120.181 -0.608 . . . . 0.0 109.77 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.9 tp -58.83 -40.76 85.13 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.77 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 95.1 p -62.32 -33.92 75.61 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.141 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 19.5 tp -60.39 -42.9 96.86 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.13 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 27.2 m -83.2 -11.53 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.735 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -67.38 -21.05 65.63 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.45 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -73.53 -39.64 64.62 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.498 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 46.4 t -89.4 -35.94 8.16 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.236 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -120.89 158.79 26.89 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.308 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.41 -179.986 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . 0.444 ' O ' ' O ' ' A' ' 661' ' ' LEU . 3.0 mp . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . 0.444 ' O ' ' O ' ' A' ' 660' ' ' LEU . 3.9 pp 39.75 -176.16 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 172.73 -179.07 0.07 Allowed 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.128 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.88 -40.59 84.84 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-O 120.791 0.329 . . . . 0.0 110.244 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -73.94 -23.97 59.59 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.851 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -67.06 -45.45 77.33 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.293 -179.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -64.47 -38.61 91.64 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.978 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.8 -47.18 48.66 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.508 -179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 89.9 p -59.58 -31.64 69.63 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.038 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 56.6 tp -56.47 -26.78 55.15 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.062 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -68.54 -9.95 52.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 119.512 -0.875 . . . . 0.0 111.997 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -62.76 -48.85 77.37 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.583 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.68 -22.57 13.55 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.347 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 48.2 p90 41.39 22.05 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -63.89 -52.8 58.28 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.782 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . 0.405 HD12 HG22 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -68.67 -33.22 58.49 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.748 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.581 -179.202 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 51.7 p -58.44 -37.78 76.13 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.619 -178.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -60.57 -41.64 95.03 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.344 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 7.0 t90 -72.81 -46.42 53.22 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.54 -33.46 15.15 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.593 0.961 . . . . 0.0 113.593 -176.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.15 -11.02 60.38 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.287 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -110.16 -30.1 7.89 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 121.093 -0.243 . . . . 0.0 110.603 179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 1.2 mm -60.0 -43.83 93.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 45.9 ttp180 -62.2 -48.45 79.95 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.244 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 80.0 mt -64.12 -44.06 97.55 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.454 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -52.65 -27.83 18.93 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.2 mp -57.54 -48.38 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.218 -177.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 49.1 mt -58.59 -41.92 83.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.321 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 69.1 mt -60.19 -45.18 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.9 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 13.4 m -68.81 2.0 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 119.811 -0.755 . . . . 0.0 112.27 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -85.6 -64.2 1.51 Allowed Glycine 0 C--N 1.347 1.173 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 29.8 m -52.1 -25.16 8.12 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.611 -0.435 . . . . 0.0 110.683 178.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -54.03 -32.58 54.79 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.785 179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -35.39 73.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.156 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.919 -178.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.02 -56.28 5.87 Favored Glycine 0 CA--C 1.537 1.43 0 C-N-CA 120.007 -1.092 . . . . 0.0 113.767 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -31.6 70.48 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.992 1.396 . . . . 0.0 110.456 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 20.1 tpp180 -50.74 -35.88 33.68 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-O 120.723 0.297 . . . . 0.0 110.348 177.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 58.1 mt -59.21 -40.35 80.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.782 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 3.5 p -55.55 -28.06 22.27 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.807 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.347 -178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -55.04 -35.4 64.42 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.929 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.78 -35.59 66.43 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.911 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 1.7 p -59.88 -34.2 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.075 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.05 -24.84 67.86 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.284 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 32.1 m -57.87 -44.75 86.83 Favored 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.778 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.54 -40.39 92.84 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 61.6 t -60.61 -28.33 42.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.342 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -63.33 -7.33 6.13 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 11.2 ttp85 -73.6 -44.82 56.18 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.485 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 43.0 t -89.42 -36.03 8.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.219 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 38.23 46.99 0.94 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 58.3 tp60 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.017 -0.992 . . . . 0.0 111.037 179.753 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 55.8 mt . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -146.84 135.36 21.97 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.287 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -168.75 137.99 2.23 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.01 -18.25 4.89 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.356 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -72.48 -31.46 65.4 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 121.058 -0.257 . . . . 0.0 110.753 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -69.43 -44.91 70.36 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.369 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 85.4 m95 -66.23 -38.84 88.88 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.355 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.4 -35.83 71.17 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.144 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 2.9 t -54.98 -31.44 60.86 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.075 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 8.7 mt -62.9 -14.8 50.95 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.934 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -68.79 -28.27 66.62 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.962 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -62.83 -47.93 81.26 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.508 -0.477 . . . . 0.0 112.197 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.44 -22.46 13.65 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.717 -178.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 53.45 7.83 0.11 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -63.45 -53.22 55.63 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.291 0.95 . . . . 0.0 112.276 -178.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 8.8 tp -68.97 -32.8 55.98 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.75 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.632 179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -59.02 -46.77 87.36 Favored 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.441 -178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -64.68 -46.67 81.45 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.823 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.4 t90 -65.18 -38.19 89.74 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.088 -179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.42 -19.34 28.2 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -100.61 9.68 42.17 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.619 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -129.99 -1.24 4.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.525 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 12.7 tt -68.46 -44.18 83.4 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 17.1 ttm105 -55.81 -47.89 76.37 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.498 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.2 mp -64.54 -36.92 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.773 179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -52.01 -39.09 58.94 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 119.101 -0.476 . . . . 0.0 112.26 -178.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.27 -38.55 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 119.79 -0.764 . . . . 0.0 109.956 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.77 -41.91 83.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 3.8 mp -66.69 -42.19 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 66.1 t -68.52 -1.78 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.202 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.151 179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -91.75 -45.57 3.92 Favored Glycine 0 C--N 1.35 1.343 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 27.3 m -53.52 -30.13 39.96 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.121 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 8.4 mp -61.71 -36.3 80.52 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.034 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . 0.404 HG23 HD12 ' B' ' 693' ' ' ILE . 0.3 OUTLIER -59.27 -33.37 50.66 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 120.164 -0.614 . . . . 0.0 110.756 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -70.03 -36.46 72.63 Favored Glycine 0 CA--C 1.534 1.241 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 179.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.14 -31.6 63.49 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.426 -178.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.16 -31.56 13.89 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 48.7 mm -59.91 -48.29 88.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.427 -177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 16.1 m -66.75 -28.36 42.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.752 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -55.49 -26.82 44.77 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.623 -179.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.6 -40.68 79.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.459 -0.496 . . . . 0.0 109.875 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 63.0 t -64.49 -42.62 95.76 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.11 -38.64 89.66 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.472 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 68.1 m -57.91 -34.54 69.95 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.963 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.8 tp -66.1 -42.1 89.7 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.995 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.69 -17.43 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.915 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -60.96 -26.2 67.37 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.465 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -73.79 -36.45 65.04 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.851 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 43.0 t -82.91 -36.13 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.273 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 66.3 mtm180 -144.01 130.92 20.39 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.709 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 C--O 1.22 -0.479 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.648 -179.97 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 3.1 tt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 28.3 mt -136.27 132.04 35.22 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -170.6 -176.51 2.12 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.099 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.45 -31.39 34.47 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.371 -179.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -71.21 -40.35 71.2 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.707 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.7 mmtt -70.22 -43.51 70.5 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.169 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -60.24 -44.67 95.03 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.96 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.63 -41.04 88.93 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.534 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 20.1 m -56.58 -31.94 64.73 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.269 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 9.2 tp -70.48 -4.72 24.15 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -72.71 -13.77 61.41 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -178.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -62.77 -50.42 71.12 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 118.291 -1.364 . . . . 0.0 110.593 -178.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . 0.415 ' O ' ' N ' ' C' ' 674' ' ' ASP . 0.3 OUTLIER -101.75 -23.35 14.22 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 178.881 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 49.0 p90 42.01 9.19 0.0 OUTLIER 'General case' 0 C--N 1.362 1.128 0 N-CA-C 116.408 2.003 . . . . 0.0 116.408 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' C' ' 672' ' ' TRP . 30.2 t70 -64.22 -53.97 40.9 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 120.156 1.344 . . . . 0.0 110.662 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 9.3 tp -69.88 -29.67 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.454 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 17.3 m -58.45 -40.02 81.5 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.504 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.43 -46.31 90.5 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 119.964 -0.694 . . . . 0.0 109.564 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -56.84 -39.09 73.6 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.259 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.01 -2.87 42.31 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -179.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 4.7 t90 -146.83 44.06 1.17 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 119.772 -0.771 . . . . 0.0 112.325 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -161.18 -42.32 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . 0.443 HD11 HG23 ' C' ' 682' ' ' ILE . 0.1 OUTLIER -55.88 -36.91 45.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.49 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 3.5 ptt-85 -55.81 -40.73 73.16 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 40.5 mm -59.85 -41.3 85.3 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -67.09 -27.77 67.63 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.807 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.1 tp -57.89 -43.6 84.83 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.727 -177.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 39.2 mt -59.27 -41.64 84.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.027 -179.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 3.4 mp -56.82 -41.5 75.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 52.4 t -67.67 -31.38 52.2 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.126 0 CA-C-O 118.684 -0.674 . . . . 0.0 112.197 -177.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -62.74 -53.48 40.83 Favored Glycine 0 CA--C 1.538 1.491 0 CA-C-N 119.415 1.007 . . . . 0.0 111.632 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.5 m -61.83 -24.39 66.86 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 117.231 0.515 . . . . 0.0 112.377 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.5 tp -54.22 -32.63 56.36 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.711 -178.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.3 pp -70.19 -28.07 34.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 120.259 -0.576 . . . . 0.0 111.134 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.71 -55.27 23.57 Favored Glycine 0 CA--C 1.542 1.778 0 C-N-CA 121.182 -0.532 . . . . 0.0 113.125 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.3 tt -58.42 -36.45 73.63 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.56 -35.85 31.78 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -178.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.18 -41.02 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.18 -178.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 64.9 t -56.49 -29.0 27.91 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.827 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -56.05 -35.25 66.7 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.35 -34.93 64.69 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.103 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 9.3 p -59.06 -31.53 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.5 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.59 -30.54 67.27 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.391 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.3 t -57.93 -39.0 76.95 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.849 -0.341 . . . . 0.0 110.428 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 16.3 tp -56.51 -31.21 63.87 Favored 'General case' 0 C--O 1.218 -0.588 0 C-N-CA 120.635 -0.426 . . . . 0.0 109.871 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.8 t -75.66 -17.57 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.042 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -60.66 -22.36 63.77 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.18 -3.7 58.9 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 120.625 -0.43 . . . . 0.0 112.018 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 48.3 t -104.41 -36.03 3.77 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.534 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.319 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 -123.94 176.61 6.22 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.959 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 118.369 -0.824 . . . . 0.0 112.3 -179.806 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 pt? . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 9.5 mp -99.72 155.38 17.66 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.252 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -163.51 159.78 22.42 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.758 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 8.9 tt -61.83 -40.53 95.61 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.775 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -72.68 -23.91 60.94 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.478 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -64.41 -40.0 94.93 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.914 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -70.25 -49.61 48.14 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.148 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.81 -31.38 72.32 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.48 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 1.8 m -57.43 -31.59 66.05 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.112 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 70.4 mt -71.27 -4.83 27.97 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -68.98 -1.0 6.37 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -62.32 -49.17 76.69 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 118.41 -1.316 . . . . 0.0 111.887 -176.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -104.23 -11.04 17.46 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.832 177.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.3 p90 43.33 18.84 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -64.42 -52.93 55.61 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.507 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.1 tp -68.84 -28.35 39.41 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.316 -179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 75.7 p -58.9 -40.35 84.2 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 119.818 -0.753 . . . . 0.0 109.386 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -65.33 -33.83 76.9 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.807 178.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 42.3 t90 -69.83 -44.56 69.72 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.868 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.68 -2.6 7.17 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.222 -178.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -136.48 -58.43 0.74 Allowed 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 119.723 -0.791 . . . . 0.0 112.874 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -72.52 -41.44 65.88 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 120.482 -0.487 . . . . 0.0 112.258 -177.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 28.9 mm -67.26 -36.44 76.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -55.29 -48.03 74.68 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.185 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.91 -43.14 91.52 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 C-N-CA 120.991 -0.283 . . . . 0.0 111.178 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -52.57 -28.71 22.1 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -177.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.95 -37.83 63.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 CA-C-O 119.188 -0.434 . . . . 0.0 111.18 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.11 -41.95 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.077 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 5.1 mp -64.56 -40.97 90.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 21.9 t -68.32 4.38 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -110.71 -5.77 27.29 Favored Glycine 0 CA--C 1.543 1.828 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 178.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 54.2 m -88.24 -32.84 18.33 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 117.141 0.471 . . . . 0.0 111.343 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.67 -32.6 52.29 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.089 -178.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -54.82 -34.18 29.98 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 120.3 -0.56 . . . . 0.0 109.898 179.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.42 -43.82 36.22 Favored Glycine 0 C--N 1.346 1.117 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 177.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.43 -37.43 70.2 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.151 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -50.68 -35.37 30.58 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 122.776 0.431 . . . . 0.0 111.152 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 75.2 mt -59.31 -41.97 85.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 CA-C-O 118.994 -0.527 . . . . 0.0 111.214 -176.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 2.4 p -67.6 -28.49 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 118.956 0.798 . . . . 0.0 111.074 179.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -55.06 -35.01 64.06 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.461 0.172 . . . . 0.0 110.642 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.42 -35.49 65.44 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.895 -178.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.59 -38.23 77.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.758 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.62 -29.07 69.81 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.755 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 4.0 t -63.62 -31.91 73.22 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.101 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 30.6 tp -62.73 -39.52 94.35 Favored 'General case' 0 C--O 1.218 -0.588 0 O-C-N 123.102 0.251 . . . . 0.0 111.085 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 35.1 m -82.65 -10.8 12.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -63.81 -24.06 67.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 120.725 -0.39 . . . . 0.0 112.027 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 12.6 ptt-85 -76.6 -19.13 58.18 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 120.378 -0.529 . . . . 0.0 112.305 -179.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 6.7 m -104.99 26.05 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 55.2 mtm180 -86.53 152.95 22.2 Favored 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.572 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.068 -0.967 . . . . 0.0 110.917 -179.908 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 3.6 pp . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 70.2 mt -124.65 154.61 40.48 Favored 'General case' 0 C--O 1.22 -0.479 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.101 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -147.83 145.87 28.89 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.783 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 4.6 tt -54.95 -40.01 69.52 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 121.016 0.436 . . . . 0.0 110.325 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.57 -35.46 77.43 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.701 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -68.14 -43.04 79.21 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.45 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 83.3 m95 -59.75 -48.71 80.59 Favored 'General case' 0 C--O 1.22 -0.449 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.374 179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -54.23 -33.03 57.47 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.757 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.51 -32.97 69.32 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.098 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 49.0 tp -59.53 -17.34 31.43 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.712 179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -68.64 -17.07 64.03 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -89.46 -16.65 30.34 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -86.49 -22.66 26.3 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.32 -177.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 41.0 t80 59.87 -73.06 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -51.44 -53.01 41.37 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -176.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 5.0 tp -68.27 -27.93 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 119.829 -0.749 . . . . 0.0 110.777 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.3 m -63.25 -48.28 78.88 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.589 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -71.24 -41.36 70.23 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.785 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.5 t90 -62.81 -44.22 96.74 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.331 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.78 -27.51 58.04 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.557 -178.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.6 t90 -91.89 0.02 57.49 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -119.0 -6.28 10.5 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.626 -0.43 . . . . 0.0 112.092 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 7.8 pt -63.44 -42.65 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.669 -179.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -43.95 77.01 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.769 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 56.8 mt -66.65 -37.74 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 178.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -55.8 -29.97 60.59 Favored 'General case' 0 C--O 1.218 -0.601 0 C-N-CA 121.112 -0.235 . . . . 0.0 111.47 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 27.2 mm -60.02 -41.84 87.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.45 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.82 -41.82 83.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 2.8 mp -61.93 -42.33 94.31 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 60.0 t -68.64 -2.14 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.237 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -86.33 -55.83 2.4 Favored Glycine 0 C--N 1.351 1.368 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 21.9 m -58.08 -30.79 66.5 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.741 179.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.3 tp -54.71 -34.35 62.26 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.772 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.91 -27.76 23.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 120.349 -0.541 . . . . 0.0 111.321 -179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.86 -41.65 87.85 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.53 -31.79 64.48 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 121.249 -0.18 . . . . 0.0 111.021 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.98 -30.94 16.39 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 58.9 mt -59.44 -41.53 84.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.085 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 47.4 t -65.28 -28.59 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.496 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.47 -26.66 43.69 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.035 -179.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -51.37 -37.04 46.01 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.735 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.27 -42.42 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.547 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.53 -29.09 69.78 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.035 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 20.9 t -57.98 -32.35 67.79 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.609 -0.437 . . . . 0.0 111.279 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 26.1 tp -66.08 -40.94 91.22 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.241 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -64.63 -25.62 38.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.788 0 C-N-CA 120.726 -0.389 . . . . 0.0 110.17 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -67.27 -13.07 61.64 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.433 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.26 -31.74 13.33 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 120.396 0.141 . . . . 0.0 110.671 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 20.4 t -87.79 25.96 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.398 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -50.61 117.89 2.73 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 122.148 -0.345 . . . . 0.0 111.29 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.369 -179.998 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 4.2 pp -162.58 151.25 14.75 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 120.807 0.337 . . . . 0.0 111.219 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -171.26 179.25 3.04 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.903 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.11 -30.99 71.4 Favored 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.449 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.49 -36.44 78.93 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.651 -0.419 . . . . 0.0 110.845 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 59.1 mmtt -70.43 -42.37 71.66 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.369 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -70.4 -53.99 14.25 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.62 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.58 -37.51 75.93 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.4 t -62.83 -33.46 75.28 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.844 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 19.9 tp -70.99 -5.28 29.95 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -68.58 -6.11 23.68 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -79.9 -49.64 11.62 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 119.567 -0.853 . . . . 0.0 113.269 -178.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -89.94 -23.77 21.48 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 114.738 1.384 . . . . 0.0 114.738 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 55.17 -10.26 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 178.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -63.9 -54.53 33.28 Favored 'General case' 0 C--N 1.352 0.715 0 CA-C-N 120.465 1.484 . . . . 0.0 112.381 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 7.9 tp -70.14 -32.81 52.31 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.962 178.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -58.77 -39.07 79.93 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.916 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -59.73 -47.51 85.36 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 120.365 -0.534 . . . . 0.0 109.692 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 19.5 t90 -72.61 -28.27 62.67 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.132 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.45 -4.05 10.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.521 -179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -142.48 -179.09 6.09 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 64.58 -11.3 0.13 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.01 -37.07 59.18 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 CA-C-N 119.444 1.02 . . . . 0.0 110.5 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 41.0 mtt85 -60.71 -48.3 82.41 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.886 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 97.4 mt -62.7 -44.07 99.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.725 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.76 -28.53 69.94 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.484 0.49 . . . . 0.0 110.154 178.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.64 -38.77 73.34 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.832 -178.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 45.7 mt -67.11 -42.92 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.268 -178.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 4.0 mp -57.97 -41.06 79.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-O 119.477 -0.297 . . . . 0.0 111.772 -178.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 38.3 t -67.56 -20.06 25.91 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -176.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -90.77 14.38 63.28 Favored Glycine 0 CA--C 1.545 1.942 0 CA-C-N 119.994 1.27 . . . . 0.0 113.409 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.6 m -88.68 -34.25 17.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.365 1.083 . . . . 0.0 112.418 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.16 -33.09 72.86 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.982 -178.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.1 pp -57.81 -40.05 74.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 119.794 -0.762 . . . . 0.0 110.267 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.9 -53.36 46.98 Favored Glycine 0 CA--C 1.539 1.593 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 7.7 tt -56.63 -31.6 64.49 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 -50.55 -36.52 34.83 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 -178.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.67 -41.64 85.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.582 -177.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.6 -28.87 45.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.64 -35.16 73.84 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.667 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.3 -35.41 65.06 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.148 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 80.4 t -59.54 -31.41 46.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.029 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.4 tp -58.34 -34.29 70.47 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.418 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 29.2 p -58.0 -37.61 74.6 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.561 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.8 tp -57.59 -39.9 77.84 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.671 -0.411 . . . . 0.0 109.946 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 28.9 t -72.82 -31.43 36.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.702 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -60.92 -8.82 3.43 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -109.65 -32.84 6.96 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 39.8 t -82.94 -29.13 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.835 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 -130.92 122.43 26.94 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.042 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 . . . . . 0 C--O 1.221 -0.431 0 CA-C-O 118.136 -0.935 . . . . 0.0 110.944 179.994 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 44.4 mt 60.23 115.31 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.144 -179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -165.65 168.5 16.21 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.208 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.3 tt -52.52 -38.82 60.47 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.823 -179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.15 -34.62 68.65 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.518 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -68.18 -44.32 76.16 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.356 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -58.7 -44.1 90.24 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-O 120.815 0.34 . . . . 0.0 110.942 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -51.68 -19.66 1.69 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.142 -178.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 32.1 t -64.69 -32.65 74.42 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.421 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -69.82 -20.49 63.44 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -68.89 -17.22 63.94 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.905 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -63.24 -35.49 80.52 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -179.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 3.9 m95 -94.84 -23.44 17.48 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 119.76 -0.776 . . . . 0.0 111.099 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 18.5 t80 66.8 -41.74 0.4 Allowed 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 178.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -52.09 64.32 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -177.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 8.1 tp -62.92 -29.91 48.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.719 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.177 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.4 m -59.69 -37.57 79.16 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.835 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -66.27 -23.16 66.35 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.503 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -72.05 -46.4 57.14 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.225 -179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.11 -24.45 19.12 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -177.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -74.07 -0.59 16.96 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 119.397 -0.921 . . . . 0.0 111.607 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -128.31 -25.07 3.01 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.617 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.4 tt -55.56 -36.6 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.874 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 26.9 ttp-105 -55.84 -48.42 75.52 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 29.3 mt -64.89 -45.97 93.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -52.83 -33.22 48.39 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.9 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.1 mp -58.4 -42.81 85.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 3.7 mm -58.44 -42.14 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 119.907 -0.717 . . . . 0.0 109.564 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 41.8 mm -57.08 -41.01 76.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-N 116.965 -0.107 . . . . 0.0 110.958 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 42.8 t -67.75 -0.09 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 C-N-CA 120.158 -0.617 . . . . 0.0 111.495 -178.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.97 -40.23 8.18 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 177.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 4.3 m -77.86 -16.92 57.91 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.461 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.5 tp -58.83 -44.04 90.8 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.171 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -30.48 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.231 179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.55 -37.82 78.34 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.335 -1.506 . . . . 0.0 109.335 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.57 -35.97 68.78 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 120.572 0.225 . . . . 0.0 110.752 179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.55 -33.89 23.48 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 123.249 0.62 . . . . 0.0 111.479 178.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 77.3 mt -57.8 -40.08 74.13 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.457 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 16.8 m -55.62 -28.21 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 119.227 0.921 . . . . 0.0 110.77 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . 0.409 ' HA ' ' HB3' ' A' ' 702' ' ' LEU . 28.9 m-85 -55.45 -36.43 66.53 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.58 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.77 -48.02 78.83 Favored 'General case' 0 C--O 1.219 -0.553 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.92 -43.78 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . 0.409 ' HB3' ' HA ' ' A' ' 699' ' ' PHE . 0.6 OUTLIER -58.88 -24.81 62.72 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.729 178.629 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.7 -43.16 94.22 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.376 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.0 tp -65.27 -36.71 84.93 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-O 121.085 0.469 . . . . 0.0 110.062 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.61 -36.1 68.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.052 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.88 -8.74 3.34 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.888 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.95 -45.64 49.03 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 120.594 0.235 . . . . 0.0 111.038 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 6.9 t -98.78 26.49 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.563 -179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -36.16 146.26 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 . . . . . 0 C--O 1.219 -0.528 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.164 -179.245 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 39.6 mt . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 49.47 -152.04 0.15 Allowed 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -170.49 65.7 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.32 0.509 . . . . 0.0 111.272 -178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 5.8 tt -66.88 -41.11 87.76 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 119.981 -0.688 . . . . 0.0 111.974 -179.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -74.58 -29.28 61.27 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.092 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 1.1 tptm -70.46 -25.46 63.19 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 118.889 -0.577 . . . . 0.0 111.917 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 91.9 m95 -58.91 -50.7 73.05 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 119.051 -1.059 . . . . 0.0 108.435 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.65 -41.89 95.8 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.996 -178.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 37.9 m -65.85 -31.74 72.87 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.52 -0.472 . . . . 0.0 109.911 178.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 29.8 mt -72.46 -4.98 33.61 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.155 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -68.41 -3.0 9.74 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.574 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 29.6 m-20 -89.38 -12.71 39.6 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -178.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -88.92 -22.75 22.95 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.716 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 60.0 -72.38 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -51.74 -52.31 49.63 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -31.12 50.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 119.571 -0.852 . . . . 0.0 110.569 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.9 m -58.74 -43.21 90.17 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.96 -37.83 83.77 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.108 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -71.63 -42.08 68.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.045 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.13 -6.57 18.2 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 119.367 -0.933 . . . . 0.0 111.114 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 1.9 t90 -129.61 176.4 8.02 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 72.36 -19.48 0.29 Allowed 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 27.2 pt -55.76 -37.05 45.37 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 CA-C-N 118.169 0.44 . . . . 0.0 110.453 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -45.65 91.26 Favored 'General case' 0 C--O 1.219 -0.541 0 O-C-N 123.102 0.251 . . . . 0.0 110.408 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 38.1 mt -67.15 -38.08 80.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.43 -28.87 60.73 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.514 -178.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 22.4 mm -63.8 -41.06 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.842 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 3.6 mp -58.82 -42.16 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 4.0 mp -62.82 -43.11 98.59 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.55 -1.93 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.181 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.099 179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -89.79 -61.47 1.36 Allowed Glycine 0 C--N 1.349 1.296 0 N-CA-C 110.619 -0.993 . . . . 0.0 110.619 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 2.9 m -53.22 -20.81 4.43 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.127 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.21 -32.58 62.37 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 121.247 -0.181 . . . . 0.0 110.841 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.5 -38.3 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.075 -179.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -65.58 -45.07 91.45 Favored Glycine 0 C--O 1.213 -1.195 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.706 -179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.87 -39.35 74.17 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -50.55 -31.41 15.61 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 7.9 tp -59.69 -41.58 85.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 C-N-CA 119.776 -0.77 . . . . 0.0 111.619 -177.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 84.1 t -58.99 -28.31 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 121.289 -0.164 . . . . 0.0 111.019 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -24.87 36.62 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.22 -35.08 16.42 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 119.173 -0.441 . . . . 0.0 112.154 -177.469 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 34.8 m -59.24 -36.04 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.029 179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.9 tt -68.52 -40.18 80.88 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 31.1 p -59.73 -31.94 70.08 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.711 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.01 -25.59 67.01 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 120.662 -0.415 . . . . 0.0 109.973 179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 59.1 t -90.22 -10.75 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.952 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -65.32 -10.74 35.24 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -73.98 -39.23 63.82 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 119.817 -0.753 . . . . 0.0 110.82 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 29.9 t -91.3 -4.42 10.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.342 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 75.8 ttt-85 -57.47 132.97 54.75 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.46 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.888 -179.964 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 119.444 -0.313 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.84 -84.84 0.02 OUTLIER 'General case' 0 C--N 1.348 0.543 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.54 -179.224 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -175.68 72.45 0.02 OUTLIER 'General case' 0 C--N 1.354 0.773 0 CA-C-N 118.805 0.729 . . . . 0.0 112.283 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.29 -40.07 93.35 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.057 179.077 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -74.37 -29.74 61.68 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -70.57 -29.36 65.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.452 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 37.5 m95 -58.52 -49.61 76.75 Favored 'General case' 0 C--O 1.22 -0.447 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.39 90.86 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.527 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 6.0 m -62.34 -31.02 71.6 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.661 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 9.7 tp -55.36 -16.64 3.74 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.379 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 26.2 m95 -68.66 -15.44 63.52 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.291 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -62.59 -42.75 99.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.149 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.4 m95 -79.93 -22.38 42.77 Favored 'General case' 0 CA--C 1.552 1.048 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 15.5 t80 70.22 -51.94 0.65 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.982 1.265 . . . . 0.0 112.711 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -52.44 63.0 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 6.4 tp -68.44 -30.97 49.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.393 -179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 94.4 m -63.41 -50.28 70.43 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.844 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -68.6 -44.16 74.9 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 123.354 0.409 . . . . 0.0 110.951 -179.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 10.2 t90 -61.39 -43.56 98.66 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.937 -179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.92 -33.18 45.72 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.215 -179.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 21.9 t90 -59.61 -37.43 78.57 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.97 -178.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 2.3 p90 -123.93 29.93 6.32 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 119.973 -0.691 . . . . 0.0 112.334 -178.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 7.1 tp -55.77 -37.03 45.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.66 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.859 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.0 -34.66 78.5 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.239 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 95.0 mt -62.5 -46.22 96.92 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.556 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -57.99 -29.54 65.34 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.381 -179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 21.8 mm -64.01 -44.1 97.76 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.985 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.9 mt -58.96 -41.41 83.03 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 73.9 mt -56.58 -41.53 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 58.7 t -67.63 -31.5 52.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.042 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.19 -38.67 87.47 Favored Glycine 0 C--N 1.353 1.518 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 178.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 10.7 m -78.28 -24.33 46.83 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 117.139 0.47 . . . . 0.0 111.183 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.48 -43.58 96.87 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.217 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -61.96 -38.21 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.156 179.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.73 -36.4 89.63 Favored Glycine 0 CA--C 1.544 1.884 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.315 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.7 tt -55.99 -31.16 62.78 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 117.049 0.425 . . . . 0.0 111.87 -178.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -49.98 -34.76 22.01 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 9.0 tp -58.24 -40.88 79.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.2 p -56.12 -28.93 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 119.551 1.068 . . . . 0.0 110.992 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.58 -35.08 79.77 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.634 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.09 -35.78 64.96 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.522 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 69.9 t -60.0 -31.95 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.118 178.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.87 -30.69 67.93 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.867 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 15.4 m -58.24 -40.49 81.9 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.246 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 16.3 tp -55.95 -26.8 49.63 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.622 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 20.4 t -81.59 -24.65 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.372 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -60.57 -20.83 61.63 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.05 -42.66 59.88 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 120.742 0.305 . . . . 0.0 110.558 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 20.4 t -97.32 2.23 10.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.372 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? 56.64 172.51 0.04 OUTLIER 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.628 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.81 -179.862 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 2.2 mm? . . . . . 0 N--CA 1.489 1.506 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 7.2 tt 55.4 104.23 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.954 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -139.97 161.38 37.74 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.39 179.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -37.76 86.68 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.128 -179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 -74.84 -26.47 59.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.595 178.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.07 -46.07 85.94 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -65.17 -48.27 74.08 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.052 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.32 -28.67 59.65 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.756 -179.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.3 t -62.15 -31.91 72.45 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.165 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.9 mp -72.28 -14.26 61.71 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -68.61 -25.07 64.67 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.608 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 37.9 t-20 -62.55 -36.42 82.58 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.5 m95 -83.36 -22.89 32.69 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.334 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 67.89 -40.13 0.41 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -62.04 -52.34 64.32 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.1 tp -68.16 -38.47 79.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 119.872 -0.731 . . . . 0.0 111.048 -179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -61.87 -44.43 96.84 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 119.933 -0.707 . . . . 0.0 109.579 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -65.52 -37.68 87.45 Favored 'General case' 0 C--O 1.214 -0.787 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.207 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 7.5 t90 -70.72 -34.5 71.98 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -67.64 -3.42 8.96 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 120.468 -0.493 . . . . 0.0 111.456 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.98 150.69 49.35 Favored 'General case' 0 C--O 1.211 -0.966 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 84.08 -23.0 0.19 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.453 0.701 . . . . 0.0 110.473 -178.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 1.4 tp -67.62 -42.93 87.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 21.2 ttp-105 -60.59 -48.07 83.38 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.83 -38.03 74.36 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.13 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -52.7 -43.28 65.51 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.527 -178.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.8 mp -58.29 -37.89 65.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.9 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 81.2 mt -58.17 -43.8 86.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 61.2 mt -58.32 -41.43 81.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 177.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 43.5 t -67.74 -3.09 2.06 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.348 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -86.29 -53.83 2.86 Favored Glycine 0 C--N 1.349 1.277 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 178.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 15.9 m -61.36 -20.62 63.21 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.735 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.7 tp -54.04 -46.91 72.03 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.593 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 2.1 pp -55.97 -41.21 66.89 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.867 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.84 -51.62 52.11 Favored Glycine 0 C--O 1.214 -1.098 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.2 tt -60.08 -34.23 73.16 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.993 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -65.35 -36.41 83.94 Favored 'General case' 0 C--O 1.214 -0.786 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -178.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 4.9 pt -58.98 -40.41 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 CA-C-N 119.708 1.14 . . . . 0.0 112.352 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 5.2 p -55.59 -26.79 20.32 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.915 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.33 -178.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -54.27 -33.88 59.62 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.28 -35.53 62.67 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 119.042 -0.504 . . . . 0.0 111.968 -176.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 32.9 m -61.09 -31.92 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.481 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -24.39 63.93 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.551 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 33.9 m -57.45 -43.11 83.66 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.919 -178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.2 tp -70.24 -36.45 74.49 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.122 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 56.9 t -60.68 -35.7 65.74 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.568 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -60.94 -21.29 63.28 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.662 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 45.1 mtp85 -101.92 -22.5 14.31 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.435 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 17.0 t -108.67 26.15 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.552 -179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.42 -23.85 52.01 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.474 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.706 -179.917 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.234 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 65.6 mt -137.47 124.3 21.25 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.498 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -151.26 176.51 11.15 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.581 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -52.19 -18.19 1.4 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.945 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -74.51 -47.97 29.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.243 178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -70.24 -38.59 75.21 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.101 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 71.8 m95 -64.96 -37.12 86.61 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.015 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.86 -46.0 88.81 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.171 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 1.9 t -59.76 -31.75 69.94 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.068 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.37 -26.36 52.67 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.174 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -68.77 -2.86 10.35 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 119.592 -0.843 . . . . 0.0 112.007 -179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -75.71 -19.09 59.34 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.619 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 5.5 m95 -102.98 -23.2 13.72 Favored 'General case' 0 C--O 1.211 -0.935 0 C-N-CA 120.166 -0.614 . . . . 0.0 111.557 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 64.07 -59.13 0.2 Allowed 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -51.0 -52.39 43.37 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.5 tp -68.21 -35.52 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 120.308 -0.557 . . . . 0.0 111.237 -179.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 15.2 m -62.3 -44.75 95.79 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.319 -0.552 . . . . 0.0 110.689 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -66.3 -46.94 75.22 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -64.47 -38.68 91.87 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.534 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 8.3 tp -74.27 -20.19 60.23 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -109.4 9.22 25.62 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 120.573 -0.451 . . . . 0.0 112.006 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -123.53 0.5 8.81 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.065 178.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 11.3 tt -68.24 -37.78 78.57 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 CA-C-N 116.819 -0.173 . . . . 0.0 111.31 -179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -56.16 -46.62 79.23 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.489 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 78.2 mt -68.07 -38.12 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.332 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -64.78 -40.63 95.58 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.971 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 48.2 mt -61.84 -42.29 94.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.934 -179.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.6 mt -59.49 -41.76 85.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.479 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 79.0 mt -56.69 -41.24 74.01 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 28.1 t -67.35 -28.81 43.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 120.222 -0.591 . . . . 0.0 111.706 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.38 -26.32 43.96 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 119.946 -1.121 . . . . 0.0 110.832 178.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 16.7 m -88.1 -30.21 20.03 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 116.783 0.292 . . . . 0.0 111.351 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.72 -32.56 52.45 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 120.635 0.255 . . . . 0.0 110.618 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -76.0 -27.73 18.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.892 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.76 -55.71 20.89 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 119.383 -1.389 . . . . 0.0 113.743 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.62 -29.89 70.95 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 118.138 0.969 . . . . 0.0 113.314 -178.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 14.4 mmt180 -49.38 -30.4 7.74 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 43.3 pt -58.35 -38.77 71.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 118.102 0.41 . . . . 0.0 110.796 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 3.9 p -54.53 -27.46 17.72 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.37 -177.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -54.9 -26.65 37.27 Favored 'General case' 0 C--O 1.214 -0.77 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.796 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -52.67 -35.64 55.55 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 53.3 t -59.65 -31.34 46.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.54 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 34.1 tp -58.22 -33.89 69.82 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.505 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 7.9 m -58.24 -31.8 67.73 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 6.4 mp -77.63 -43.15 32.38 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 33.5 m -93.0 -10.66 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -178.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -60.74 -34.11 73.93 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.439 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.23 -0.73 52.77 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 61.3 t -84.1 -36.05 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 120.594 -0.443 . . . . 0.0 110.062 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -164.95 23.01 0.06 Allowed 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.44 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 118.305 -0.855 . . . . 0.0 112.394 179.86 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -169.25 -38.94 0.02 OUTLIER 'General case' 0 C--O 1.21 -0.975 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.942 -178.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 94.38 148.48 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.976 0.91 . . . . 0.0 109.476 -179.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 9.3 tt -52.34 -40.35 61.82 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -176.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -67.05 -39.58 86.93 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.353 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -70.68 -43.5 68.95 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.03 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 64.6 m95 -58.85 -48.46 81.28 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.06 -47.32 85.19 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.458 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 2.5 m -61.54 -31.83 71.87 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.337 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 8.8 tp -56.0 -11.51 1.1 Allowed 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -68.68 -18.86 64.34 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -63.87 -44.8 91.99 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 14.1 m95 -79.96 -22.79 42.21 Favored 'General case' 0 CA--C 1.553 1.062 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -176.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 65.89 -68.93 0.12 Allowed 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 119.976 1.262 . . . . 0.0 112.435 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -52.15 -51.88 55.21 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 8.8 tp -67.24 -28.96 44.29 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.961 -179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 22.4 m -58.94 -48.6 80.91 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.976 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -68.8 -43.94 74.61 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.476 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 19.9 t90 -63.49 -19.65 64.93 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -88.97 -2.62 58.67 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.448 -179.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -134.75 -41.33 0.77 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 120.291 -0.563 . . . . 0.0 111.83 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -62.59 -18.1 61.46 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -36.81 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 119.447 -0.901 . . . . 0.0 110.268 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -62.82 -40.2 96.65 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 38.1 mm -61.68 -46.91 95.53 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.561 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -67.45 -28.46 67.9 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.409 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.36 -43.58 86.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 21.7 mm -67.33 -42.08 87.17 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 C-N-CA 120.324 -0.551 . . . . 0.0 109.665 179.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 95.9 mt -60.69 -41.32 87.82 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.69 -178.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 17.2 m -67.45 -10.95 13.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 C-N-CA 119.119 -1.033 . . . . 0.0 112.934 -176.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -91.56 -8.47 63.95 Favored Glycine 0 CA--C 1.559 2.821 0 C-N-CA 120.055 -1.069 . . . . 0.0 114.424 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 75.5 m -88.81 -34.31 17.1 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.322 1.561 . . . . 0.0 112.847 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -31.86 49.92 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.755 -178.15 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -64.92 -34.76 72.65 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 C-N-CA 121.435 -0.106 . . . . 0.0 111.068 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.9 -55.38 31.22 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.611 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 8.6 tt -60.72 -46.34 90.78 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 66.1 mtp85 -55.28 -35.78 65.41 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -178.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 68.2 mt -59.23 -41.59 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 53.4 t -56.57 -28.09 26.5 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.992 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.209 179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . 0.444 ' O ' HD21 ' C' ' 702' ' ' LEU . 4.5 t80 -55.34 -34.94 64.67 Favored 'General case' 0 C--O 1.206 -1.232 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.99 -36.04 78.39 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -176.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 16.6 m -67.79 -39.68 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -176.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . 0.444 HD21 ' O ' ' C' ' 699' ' ' PHE . 0.0 OUTLIER -65.83 -24.12 66.83 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 118.431 -1.308 . . . . 0.0 111.617 -178.821 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 57.3 m -59.19 -40.63 86.32 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 15.7 tp -59.06 -27.08 65.19 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 120.295 -0.562 . . . . 0.0 109.911 178.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 12.3 t -74.27 -26.74 20.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.976 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -60.87 -9.43 4.13 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 5.9 mtt-85 -90.64 -23.91 20.65 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.307 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 49.9 t -91.98 -35.99 7.42 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.548 0 C-N-CA 120.921 -0.311 . . . . 0.0 110.254 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 65.2 ttp85 -100.74 67.2 1.24 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.123 0.487 . . . . 0.0 110.607 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 117.787 -1.101 . . . . 0.0 111.18 179.939 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -122.86 146.81 47.24 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -157.97 170.16 22.95 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.14 -0.624 . . . . 0.0 111.368 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 4.6 tt -61.76 -40.37 94.92 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.386 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -71.27 -26.63 62.97 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.104 -179.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 33.8 mtpt -70.17 -43.87 69.93 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.567 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 89.8 m95 -66.83 -47.98 70.33 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.586 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.36 -30.79 68.66 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 120.471 -0.492 . . . . 0.0 111.01 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.2 t -58.12 -32.47 68.16 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.249 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 25.0 mt -60.01 -11.92 6.89 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.596 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 16.1 m95 -67.93 -42.2 81.39 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.855 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -63.72 -15.4 58.42 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.856 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . 0.556 ' O ' ' N ' ' A' ' 674' ' ' ASP . 93.4 m95 -103.19 16.91 25.34 Favored 'General case' 0 C--O 1.21 -0.99 0 CA-C-O 118.742 -0.647 . . . . 0.0 111.776 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -7.24 -49.91 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 115.47 1.655 . . . . 0.0 115.47 -178.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . 0.556 ' N ' ' O ' ' A' ' 672' ' ' TRP . 25.8 t70 -50.8 -52.34 41.96 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 119.175 -0.44 . . . . 0.0 111.459 179.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 8.5 tp -68.65 -30.74 48.29 Favored 'Isoleucine or valine' 0 C--N 1.354 0.779 0 C-N-CA 119.477 -0.889 . . . . 0.0 111.131 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.4 m -59.2 -44.49 92.25 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 58.4 m-80 -60.4 -44.18 95.95 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 54.6 t90 -58.15 -34.86 70.75 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.153 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 53.5 mt -84.6 -2.82 57.99 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -136.29 7.81 3.13 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -179.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -129.52 -27.62 2.37 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 120.197 -0.601 . . . . 0.0 111.769 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 16.6 tt -61.49 -37.73 78.47 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.149 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 34.4 ttp-105 -55.75 -48.38 75.34 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 120.292 -0.563 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.68 -45.93 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -52.78 -40.91 63.62 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 121.219 -0.192 . . . . 0.0 111.335 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 1.3 mp -58.16 -38.04 65.79 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 CA-C-O 119.24 -0.41 . . . . 0.0 110.544 -179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.37 -43.26 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.198 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 4.0 mp -62.27 -41.46 91.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.49 3.74 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -109.31 -9.86 24.83 Favored Glycine 0 CA--C 1.545 1.911 0 C-N-CA 120.911 -0.661 . . . . 0.0 111.492 178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.7 m -88.17 -28.66 21.07 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 117.098 0.449 . . . . 0.0 112.051 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.51 -32.32 49.94 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.335 -178.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 4.8 tp -53.88 -39.56 40.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.569 -178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -70.57 -36.97 68.37 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 177.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.65 -31.85 64.77 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.533 -0.334 . . . . 0.0 110.962 179.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -61.61 -35.92 79.26 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 61.1 mt -59.15 -41.38 83.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 CA-C-O 118.973 -0.537 . . . . 0.0 112.092 -176.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 5.3 p -56.76 -29.09 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 118.865 0.757 . . . . 0.0 111.473 -179.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -55.68 -35.37 65.94 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.242 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.39 -35.41 65.28 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.383 -178.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 1.3 p -59.6 -31.67 47.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 178.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 11.3 tp -58.64 -24.53 61.33 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.796 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 68.4 m -57.57 -43.24 84.4 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.396 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.45 -42.93 99.82 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.57 -34.17 66.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.19 178.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -67.27 -32.14 72.95 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.584 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -73.94 -22.2 59.75 Favored 'General case' 0 C--O 1.219 -0.506 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.556 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 59.6 t -82.97 -36.18 12.82 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.496 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.127 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -142.79 -76.34 0.26 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.374 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.607 179.725 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 4.3 mp . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.81 136.96 53.08 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.597 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -149.82 175.38 11.68 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 123.34 0.4 . . . . 0.0 110.797 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -40.22 94.91 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.792 178.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -68.97 -26.33 64.98 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.867 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 4.0 tttm -68.85 -41.45 78.44 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.318 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -72.93 -53.58 10.92 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.297 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.31 -25.84 50.08 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.704 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 53.6 p -58.62 -31.84 68.46 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.898 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 67.8 mt -71.84 -15.07 62.13 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 18.7 m95 -69.08 -2.4 10.04 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -74.36 -48.16 29.78 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.029 -0.669 . . . . 0.0 110.696 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 6.7 p90 -103.3 -22.49 13.69 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.131 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.02 2.25 0.39 Allowed 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.3 -52.97 59.76 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 118.283 0.492 . . . . 0.0 111.435 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.8 tp -68.21 -31.46 51.71 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.619 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.073 179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.1 m -59.2 -43.21 92.24 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.449 -179.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -67.28 -38.58 85.3 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.377 -179.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -72.15 -46.25 57.23 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.635 -179.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 14.6 mt -75.33 -33.14 61.1 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -84.74 10.46 11.32 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 119.947 -0.701 . . . . 0.0 112.41 -178.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -128.96 -5.55 5.03 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 120.759 -0.377 . . . . 0.0 111.98 179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 2.2 pp -67.74 -43.14 86.66 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.713 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.519 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 19.1 mtp-105 -55.88 -47.89 76.55 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.186 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 84.3 mt -67.91 -38.48 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.389 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -55.26 -37.91 67.87 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 121.06 -0.256 . . . . 0.0 111.61 -178.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 16.2 mm -60.99 -40.81 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.034 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.87 -41.57 83.24 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 32.1 mm -57.51 -42.84 81.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.501 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 48.6 t -68.57 -8.65 10.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.554 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.51 -37.87 13.46 Favored Glycine 0 C--N 1.349 1.259 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.64 -27.59 62.23 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.825 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.13 -54.59 43.31 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.518 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -55.57 -28.73 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.917 -179.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.35 -50.49 44.18 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 119.46 -1.352 . . . . 0.0 111.235 -179.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.76 -31.83 65.0 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.59 -30.66 13.83 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -179.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 7.1 tp -58.78 -41.04 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -176.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 9.2 p -56.13 -28.11 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-N 118.279 0.491 . . . . 0.0 111.517 -179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -55.25 -26.84 42.37 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.587 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.48 -36.24 66.39 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 120.402 -0.519 . . . . 0.0 109.832 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 77.9 t -64.82 -41.34 91.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 10.4 tt -61.13 -38.34 86.03 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.476 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 24.3 p -59.6 -32.66 70.6 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.273 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.91 -42.33 97.44 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.103 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 59.8 t -63.1 -18.99 22.64 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.954 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.41 -34.05 75.98 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.84 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -73.81 -26.59 60.7 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.546 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 47.2 t -82.85 -36.12 12.9 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.505 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.336 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 29.1 ttt85 -150.36 -67.35 0.2 Allowed 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.824 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.419 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 2.1 tt . . . . . 0 N--CA 1.487 1.384 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.42 -160.67 0.78 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 178.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.79 141.93 26.08 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 119.884 -0.726 . . . . 0.0 110.897 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 9.7 tt -61.33 -40.17 93.22 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.924 179.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -74.06 -25.7 59.98 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.868 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -67.21 -39.83 86.35 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.974 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -62.25 -50.35 72.07 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.55 -35.62 80.68 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.299 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 59.7 p -57.73 -31.93 66.93 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.073 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 62.7 mt -60.71 -10.1 4.89 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 120.354 -0.538 . . . . 0.0 111.991 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -68.73 -13.24 62.26 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.877 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -62.82 -44.68 95.52 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.981 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -79.8 -12.8 59.75 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 119.638 -0.825 . . . . 0.0 113.146 -177.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.3 t80 69.17 -63.99 0.35 Allowed 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.734 1.152 . . . . 0.0 112.286 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -57.21 -37.56 72.39 Favored 'General case' 0 C--O 1.218 -0.588 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 8.5 tp -67.73 -37.2 78.19 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.885 -179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 4.4 m -60.97 -49.52 77.12 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.272 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -70.0 -45.07 68.06 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 120.43 -0.508 . . . . 0.0 109.634 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -55.89 -23.21 29.94 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.297 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 48.2 mt -94.12 -25.48 17.13 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.448 -0.501 . . . . 0.0 112.148 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -109.27 11.94 25.1 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -122.26 -28.01 4.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.613 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.2 pp -61.2 -41.7 90.55 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.759 0 C-N-CA 120.466 -0.493 . . . . 0.0 111.582 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 31.7 ttp-105 -58.47 -48.29 81.24 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.429 -0.508 . . . . 0.0 111.119 -179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 78.8 mt -67.67 -43.28 86.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -52.82 -28.18 21.57 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.902 -178.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 20.8 mm -58.25 -38.05 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.041 -178.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.5 mt -61.3 -42.0 91.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 68.5 mt -63.49 -41.16 91.7 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.73 178.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 90.2 t -67.18 -26.15 35.66 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 CA-C-O 118.578 -0.725 . . . . 0.0 112.412 -176.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -83.94 2.86 87.03 Favored Glycine 0 CA--C 1.55 2.225 0 C-N-CA 119.855 -1.164 . . . . 0.0 113.046 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 67.6 m -88.98 -34.57 16.8 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.657 1.229 . . . . 0.0 112.603 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.7 -31.93 71.37 Favored 'General case' 0 C--O 1.22 -0.492 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.592 -178.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -63.08 -32.39 56.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.81 -41.34 99.61 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.495 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.41 -31.47 63.92 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 117.351 0.575 . . . . 0.0 112.389 -179.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -50.71 -36.18 34.93 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -178.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 1.3 pt -59.4 -41.39 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 CA-C-N 119.273 0.942 . . . . 0.0 113.311 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 5.2 m -56.41 -27.77 25.2 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.838 0 C-N-CA 119.088 -1.045 . . . . 0.0 111.541 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -54.84 -35.43 63.97 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.838 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.67 66.45 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.952 -179.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 2.7 p -59.74 -31.48 47.31 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.961 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.7 tp -58.38 -26.2 62.93 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.746 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 2.3 m -58.56 -39.28 79.82 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.054 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 15.5 tp -59.55 -39.47 84.1 Favored 'General case' 0 C--O 1.218 -0.568 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 12.8 t -76.1 -16.79 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.156 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -60.63 -28.24 68.4 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 34.9 ptt85 -78.66 -24.28 45.24 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 120.612 -0.435 . . . . 0.0 111.53 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 18.6 t -100.23 26.24 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-O 120.661 0.267 . . . . 0.0 110.795 -179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 -53.37 129.35 31.68 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.867 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.625 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.702 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 45.0 mt -132.5 -73.52 0.51 Allowed 'General case' 0 C--O 1.213 -0.816 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.52 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 69.33 147.52 0.06 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.642 0.258 . . . . 0.0 111.034 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.56 -17.59 2.21 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.851 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -73.86 -37.13 64.87 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.042 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -70.29 -42.37 72.15 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.391 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -60.36 -50.06 75.12 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.458 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.99 80.11 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.094 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.2 m -57.44 -32.49 66.96 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.397 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.61 -14.69 45.83 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.882 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -68.44 -8.95 45.27 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.117 -0.633 . . . . 0.0 111.576 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -62.61 -48.02 81.22 Favored 'General case' 0 C--O 1.218 -0.585 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.183 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -102.47 -23.01 13.96 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.016 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 7.2 t80 51.8 6.99 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.81 -52.81 58.51 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 118.873 0.76 . . . . 0.0 111.534 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.39 -42.39 84.07 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.685 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 1.4 m -62.76 -44.81 95.21 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.233 -178.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -59.95 -46.74 88.43 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.304 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 7.8 t-105 -71.0 -46.51 62.14 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 120.628 -0.429 . . . . 0.0 112.134 -178.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 96.5 mt -74.79 -11.25 60.11 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -176.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -70.35 -3.47 17.53 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 118.927 -1.109 . . . . 0.0 110.884 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -149.44 12.91 0.83 Allowed 'General case' 0 C--N 1.352 0.685 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.22 178.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 14.9 tt -55.76 -39.63 56.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 118.841 0.746 . . . . 0.0 109.265 178.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 -70.16 -40.3 74.82 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.495 -0.482 . . . . 0.0 109.779 178.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 31.7 mt -59.73 -42.1 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.63 -37.65 58.82 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.886 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 17.5 mm -58.45 -38.66 71.33 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 C-N-CA 120.214 -0.594 . . . . 0.0 110.344 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.5 -42.91 85.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 56.4 mt -60.63 -42.91 93.51 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 57.7 t -68.5 -2.49 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.21 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.883 179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -92.94 -34.04 7.03 Favored Glycine 0 C--N 1.352 1.417 0 N-CA-C 109.966 -1.253 . . . . 0.0 109.966 178.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 56.8 m -80.36 -24.87 39.52 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -58.42 -42.62 87.63 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.224 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 3.5 tp -65.3 -28.07 43.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.52 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.83 -51.59 23.77 Favored Glycine 0 C--O 1.212 -1.257 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 178.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.41 -31.84 64.28 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-O 120.491 0.186 . . . . 0.0 110.501 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . 0.402 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 0.1 OUTLIER -56.61 -37.24 70.42 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.601 179.725 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.3 tp -60.62 -41.2 87.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 119.722 -0.791 . . . . 0.0 110.406 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 2.2 t -56.89 -28.97 29.6 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.632 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . 0.402 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 13.8 m-85 -58.32 -34.57 70.74 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 178.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.7 -35.72 63.91 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 25.1 m -60.62 -36.77 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.766 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 6.2 tt -58.99 -30.5 68.01 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.222 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 38.5 t -58.65 -44.97 90.25 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.794 -179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 5.3 tt -66.91 -36.07 81.43 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-O 120.927 0.394 . . . . 0.0 110.112 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 59.7 t -60.59 -26.87 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.695 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -62.59 -34.13 76.37 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 112.322 0.489 . . . . 0.0 112.322 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -80.01 -6.2 57.16 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 120.146 -0.622 . . . . 0.0 112.352 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 17.1 t -89.28 25.98 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.508 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 -56.63 112.23 1.23 Allowed 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.441 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 . . . . . 0 C--O 1.219 -0.54 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.999 -179.821 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 4.6 mp . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 mt 54.63 97.68 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.747 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -151.82 -179.69 7.67 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.016 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.9 tt -52.88 -36.15 58.79 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.073 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.05 -37.5 69.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.622 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -46.19 65.5 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.72 -179.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 93.4 m95 -62.57 -38.45 90.13 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.59 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -72.05 -31.46 66.16 Favored 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.082 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 6.9 t -57.37 -32.08 66.43 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.409 -0.516 . . . . 0.0 110.292 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 5.9 mp -61.0 -15.61 33.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.96 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 9.9 m95 -68.66 -2.97 10.33 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 118.965 -0.541 . . . . 0.0 112.405 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -89.04 -49.57 6.68 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.935 -178.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . 0.401 ' O ' ' N ' ' B' ' 674' ' ' ASP . 4.7 p-90 -104.21 -24.15 13.17 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.666 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 2.4 t80 47.5 -4.18 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.336 0 N-CA-C 116.951 2.204 . . . . 0.0 116.951 176.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' B' ' 672' ' ' TRP . 2.7 m-20 -63.73 -54.39 36.23 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 121.061 1.755 . . . . 0.0 113.053 -177.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 10.7 mm -69.91 -27.59 33.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.837 178.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 34.1 m -58.66 -46.81 86.36 Favored 'General case' 0 C--O 1.22 -0.478 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.7 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -65.49 -31.74 72.97 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 120.489 -0.484 . . . . 0.0 109.855 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 33.8 t90 -67.38 -45.52 76.0 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.113 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 64.4 mt -81.12 -23.27 38.46 Favored 'General case' 0 C--O 1.22 -0.464 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -177.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 9.3 t90 -92.53 0.62 57.45 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.83 -0.748 . . . . 0.0 112.385 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -130.23 -1.12 4.56 Favored 'General case' 0 C--O 1.218 -0.603 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.572 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 6.4 tp -65.89 -44.1 92.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 C-N-CA 120.512 -0.475 . . . . 0.0 111.664 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.94 -40.03 75.65 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.283 -179.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 92.8 mt -68.17 -43.86 84.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -54.74 -28.4 48.17 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.39 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 19.0 mm -58.65 -40.36 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.921 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.81 -41.63 83.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 3.7 mp -61.94 -41.46 91.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.214 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 46.5 t -67.8 -10.13 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 120.424 -0.51 . . . . 0.0 112.025 -177.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -77.81 -39.99 23.07 Favored Glycine 0 C--N 1.346 1.112 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 24.2 m -74.07 -17.26 60.98 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.706 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -33.7 68.97 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.27 -179.071 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 2.3 pp -70.9 -39.05 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.763 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.41 -42.93 98.94 Favored Glycine 0 C--O 1.217 -0.926 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.26 -31.4 63.54 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 120.584 0.231 . . . . 0.0 111.088 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.27 -30.48 11.9 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 7.2 tp -58.9 -40.75 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -175.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 7.4 p -55.96 -28.74 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 118.912 0.778 . . . . 0.0 111.747 -178.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -55.52 -24.17 30.38 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -48.61 -34.63 11.98 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -177.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 33.3 m -58.66 -31.16 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.23 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 39.1 tp -58.24 -35.76 72.2 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.366 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.2 m -58.23 -31.89 67.81 Favored 'General case' 0 C--O 1.218 -0.603 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.689 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.74 -43.5 75.76 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 120.187 -0.605 . . . . 0.0 112.078 -178.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 34.2 m -95.45 -10.3 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -60.62 -15.34 27.21 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 119.832 -0.747 . . . . 0.0 111.662 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 21.3 ptt180 -85.89 -34.39 20.99 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 120.489 -0.484 . . . . 0.0 111.189 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 27.8 m -91.4 26.08 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 120.858 -0.337 . . . . 0.0 111.381 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 23.7 mmt180 -50.8 146.61 5.69 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.185 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.662 -179.982 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 6.1 mp . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 4.6 tp 53.96 -153.62 0.28 Allowed 'General case' 0 CA--C 1.549 0.94 0 CA-C-O 118.447 -0.787 . . . . 0.0 110.193 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 122.21 168.68 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 125.861 1.664 . . . . 0.0 109.685 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 10.2 tt -61.08 -40.07 92.31 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.751 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -72.22 -23.83 61.3 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.862 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -69.05 -41.59 77.42 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.844 -178.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -65.37 -44.08 88.74 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.317 -179.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.09 -30.67 60.17 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.391 -178.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 92.9 p -59.91 -32.79 71.09 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.904 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 32.6 mt -66.59 -6.9 16.93 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -77.2 -17.6 58.38 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -62.77 -50.01 72.72 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 119.009 -1.077 . . . . 0.0 110.953 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . 0.411 ' O ' ' N ' ' C' ' 674' ' ' ASP . 7.7 p90 -96.03 -22.88 17.09 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 43.3 p90 45.45 3.21 0.0 OUTLIER 'General case' 0 C--N 1.364 1.206 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' C' ' 672' ' ' TRP . 7.2 t0 -64.24 -53.63 46.04 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 120.069 1.304 . . . . 0.0 110.463 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 8.4 tp -69.54 -29.23 40.81 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.918 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.357 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.2 m -58.63 -38.03 77.2 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 123.123 0.264 . . . . 0.0 111.393 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -59.97 -47.08 87.3 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 120.009 -0.677 . . . . 0.0 109.947 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 13.1 t90 -72.53 -37.08 68.41 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.238 179.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -2.45 6.29 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -142.57 153.31 43.42 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-O 122.083 0.944 . . . . 0.0 112.187 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 5.4 p90 56.98 -3.81 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.4 pp -62.98 -34.88 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 119.572 1.078 . . . . 0.0 109.244 176.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 19.1 ttp-105 -54.47 -31.17 55.16 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.117 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 89.5 mt -59.49 -48.08 88.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 120.516 -0.473 . . . . 0.0 109.834 179.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 27.9 m-85 -53.81 -27.96 32.49 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.284 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 31.4 mm -57.83 -38.09 63.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.942 -177.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.3 -42.11 86.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 3.8 mp -67.97 -41.56 84.74 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.731 179.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 93.3 t -67.82 -31.09 50.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.312 -178.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -77.42 13.45 11.14 Favored Glycine 0 CA--C 1.543 1.81 0 CA-C-N 120.166 1.348 . . . . 0.0 112.24 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 8.9 m -88.69 -34.13 17.32 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 117.797 0.798 . . . . 0.0 111.569 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -32.46 53.2 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.416 -179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.14 -37.78 44.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.584 179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.28 -42.52 97.36 Favored Glycine 0 CA--C 1.537 1.419 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 177.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.46 -30.46 62.92 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -49.75 -36.0 24.26 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -177.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 3.7 pt -59.37 -41.48 84.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 CA-C-N 119.577 1.081 . . . . 0.0 113.551 -176.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 12.3 m -56.38 -27.94 25.41 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.894 0 C-N-CA 119.209 -0.996 . . . . 0.0 111.542 -178.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -54.8 -34.83 63.2 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.11 -35.86 65.09 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 119.197 -0.43 . . . . 0.0 111.803 -177.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 9.8 p -64.39 -33.08 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.339 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.89 -40.48 88.89 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.521 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 16.1 m -60.51 -34.87 74.71 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.348 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 24.8 tp -58.29 -42.83 87.45 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.319 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 19.0 m -85.78 -10.8 11.34 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -61.34 -25.95 67.49 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.546 -0.461 . . . . 0.0 111.789 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -80.07 -21.36 43.48 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 120.455 -0.498 . . . . 0.0 112.252 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 29.5 m -96.12 -29.72 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.0 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.52 178.03 5.48 Favored 'General case' 0 C--O 1.219 -0.507 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.375 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.8 -179.793 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 29.1 mt . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 5.5 mp -126.31 -142.51 0.29 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-O 118.647 -0.692 . . . . 0.0 109.841 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 73.38 130.94 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.429 1.013 . . . . 0.0 109.096 -178.211 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -19.2 2.35 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.065 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -63.62 -48.44 77.33 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -71.48 -44.43 64.76 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.73 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -58.5 -35.23 71.92 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.577 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -53.75 -47.36 70.73 Favored 'General case' 0 C--O 1.215 -0.756 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.8 t -53.44 -32.56 50.4 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.321 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -14.56 59.32 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.22 -179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -68.46 -17.15 64.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.78 -179.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -68.03 -48.6 65.21 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.534 -178.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 4.7 p90 -103.46 -23.15 13.55 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 121.304 -0.158 . . . . 0.0 111.22 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 p90 40.58 18.32 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -63.87 -53.12 55.6 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 118.741 0.701 . . . . 0.0 110.945 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 7.2 tp -68.86 -27.93 37.71 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.912 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.093 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.0 m -58.96 -39.33 81.36 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.511 -179.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.04 -47.06 86.41 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.597 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -72.69 -46.25 54.75 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.9 tp -75.41 -33.26 60.95 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -176.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 13.8 t90 -89.92 4.78 48.94 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 119.691 -0.803 . . . . 0.0 112.449 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -125.06 2.54 7.97 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 120.255 -0.578 . . . . 0.0 112.349 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.6 pp -55.88 -43.34 74.18 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 C-N-CA 119.884 -0.727 . . . . 0.0 110.838 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.46 -48.28 56.62 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 121.114 -0.235 . . . . 0.0 110.698 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 97.2 mt -60.34 -46.72 94.59 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.361 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -52.76 -28.5 22.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 27.4 mm -58.12 -42.28 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.652 -178.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 47.7 mt -58.28 -41.73 81.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 120.031 -0.668 . . . . 0.0 109.342 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 36.3 mm -57.18 -41.95 78.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.554 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 59.4 t -68.13 -6.42 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.073 0 C-N-CA 120.659 -0.417 . . . . 0.0 111.339 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -70.67 -40.86 65.61 Favored Glycine 0 C--N 1.35 1.338 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 178.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -72.23 -33.46 67.57 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.327 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.68 -47.39 85.53 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.581 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -67.68 -35.14 71.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.641 -179.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -66.2 -40.19 94.77 Favored Glycine 0 CA--C 1.531 1.093 0 N-CA-C 110.039 -1.225 . . . . 0.0 110.039 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 3.1 tt -56.62 -31.82 64.68 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 115.665 -0.267 . . . . 0.0 111.486 179.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -50.79 -35.26 31.08 Favored 'General case' 0 C--O 1.215 -0.763 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 20.5 tt -58.49 -40.53 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -175.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 16.0 m -55.69 -28.69 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 119.041 0.837 . . . . 0.0 111.1 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -56.41 -35.93 68.35 Favored 'General case' 0 C--O 1.214 -0.811 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.836 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.55 -50.7 71.11 Favored 'General case' 0 C--O 1.219 -0.511 0 O-C-N 123.262 0.351 . . . . 0.0 111.28 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 22.7 m -68.56 -38.83 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.115 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.1 tt -66.17 -24.64 66.68 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.424 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 68.9 m -61.68 -44.57 96.69 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.757 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.8 tp -64.36 -36.1 83.03 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.065 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 87.4 t -60.79 -36.31 70.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.951 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -60.93 -18.16 55.29 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.883 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 10.2 ttm180 -73.87 -40.32 63.31 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 121.198 -0.201 . . . . 0.0 110.915 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 16.3 t -96.14 25.44 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.595 -179.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 42.2 ttm-85 -65.62 123.23 19.13 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.43 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 8.6 mp0 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.629 179.808 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 7.8 mp . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 19.2 tp 59.77 153.69 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 121.623 0.725 . . . . 0.0 111.565 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -95.62 42.47 1.09 Allowed 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.224 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 7.4 tt -54.6 -41.57 70.09 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.986 -179.052 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -75.07 -34.67 61.83 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.725 178.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 11.5 tmtt? -70.57 -34.56 72.33 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 123.44 0.462 . . . . 0.0 110.766 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -58.6 -54.8 43.0 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -70.68 -42.96 70.02 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.666 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 37.4 t -54.57 -31.28 56.43 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.358 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.58 -25.65 39.37 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.111 -179.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -68.52 -2.81 9.62 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.104 -0.638 . . . . 0.0 111.654 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -80.35 -28.7 37.99 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.795 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 7.4 m95 -87.62 -23.14 24.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.521 -179.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 66.5 -59.85 0.34 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 178.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -57.44 -52.63 64.59 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -177.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 5.2 tp -68.54 -34.45 65.49 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.811 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.4 m -60.37 -37.4 80.62 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 120.036 -0.665 . . . . 0.0 110.241 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -59.95 -46.44 89.39 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 7.0 t90 -71.64 -30.6 65.93 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.087 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.96 -7.51 58.1 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -118.25 -20.2 8.66 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 120.642 -0.423 . . . . 0.0 112.102 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -95.2 0.87 54.44 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.25 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 4.7 pt -56.39 -43.46 77.52 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.839 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 25.9 ttp-105 -55.68 -46.55 77.56 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.812 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.3 mp -67.39 -37.84 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 2.4 t80 -55.32 -41.54 72.56 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.074 179.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 3.5 mm -60.95 -45.15 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.373 -179.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 65.7 mt -58.93 -41.48 83.16 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 62.2 mt -56.9 -41.87 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 47.0 t -68.37 -2.24 1.87 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.12 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.261 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -83.77 -42.73 7.58 Favored Glycine 0 C--N 1.349 1.274 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 68.0 m -73.43 -21.8 60.37 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.932 -0.307 . . . . 0.0 111.063 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.15 -41.63 75.71 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.453 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -72.25 -32.78 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.525 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.3 -47.01 66.07 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 119.661 -1.257 . . . . 0.0 111.419 -179.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.82 -31.77 65.04 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.732 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -50.63 -31.11 15.12 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 19.0 tt -59.42 -41.1 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 N-CA-C 113.129 0.788 . . . . 0.0 113.129 -175.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 8.5 p -56.43 -28.72 27.09 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.787 0 CA-C-N 118.474 0.579 . . . . 0.0 111.932 -178.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -55.52 -25.79 39.35 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -50.12 -35.6 26.42 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 33.3 m -59.85 -33.38 52.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.595 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 21.2 tp -61.65 -28.06 69.11 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.314 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 17.3 m -57.98 -34.2 69.71 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 120.971 -0.292 . . . . 0.0 111.571 -179.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 14.3 tp -77.93 -42.33 33.4 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.748 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 48.8 t -66.3 -13.58 16.25 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.345 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -60.84 -34.2 74.2 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.973 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 -76.13 -35.68 59.15 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.049 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 16.6 t -89.1 26.07 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.521 -179.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -60.15 116.38 4.16 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.554 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.702 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 5.7 mt -117.39 151.55 36.8 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.013 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -174.0 -177.9 1.42 Allowed 'General case' 0 C--O 1.22 -0.493 0 O-C-N 123.306 0.379 . . . . 0.0 110.186 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.65 -40.13 86.68 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 120.873 0.368 . . . . 0.0 110.454 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.35 -28.99 66.69 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.56 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 32.9 tptt -70.11 -43.29 71.34 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.849 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -73.04 -49.16 30.27 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.088 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.18 -14.73 40.55 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.664 -179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 60.3 p -65.71 -31.69 72.83 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.533 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 8.6 mp -77.51 -6.06 52.23 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -72.12 -28.55 63.34 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -62.72 -49.89 73.25 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 118.633 -1.227 . . . . 0.0 110.756 -178.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . 0.418 ' O ' ' N ' ' C' ' 674' ' ' ASP . 6.1 p90 -95.86 -23.35 16.95 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 51.6 p90 38.66 19.12 0.0 OUTLIER 'General case' 0 C--N 1.363 1.168 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' C' ' 672' ' ' TRP . 1.0 OUTLIER -64.19 -54.0 40.48 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.448 179.855 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 1.5 pp -70.15 -33.56 55.32 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 CA-C-O 121.159 0.504 . . . . 0.0 110.491 177.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 21.0 m -58.64 -33.95 70.64 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.796 -177.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -59.9 -47.94 83.73 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 119.481 -0.888 . . . . 0.0 109.961 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . 0.421 ' CD1' ' C ' ' C' ' 678' ' ' TRP . 0.0 OUTLIER -73.43 -46.05 50.86 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.121 178.728 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 2.5 tt -67.62 -33.44 74.98 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 7.5 t90 -80.12 -17.27 53.01 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.4 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -93.03 -6.43 48.27 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.519 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 50.2 mm -56.04 -47.6 80.06 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -58.08 -42.01 84.68 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.3 178.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 41.4 mm -61.2 -48.53 88.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.861 -178.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -69.63 -28.87 66.28 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.2 mp -58.25 -50.04 79.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.584 -178.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 40.5 mt -59.08 -41.36 83.24 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.584 0 C-N-CA 120.36 -0.536 . . . . 0.0 109.629 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 84.1 mt -56.67 -41.88 75.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.88 -31.41 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.6 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.88 -43.44 92.54 Favored Glycine 0 CA--C 1.537 1.417 0 CA-C-N 119.147 0.885 . . . . 0.0 111.66 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 11.8 m -78.59 -20.31 50.77 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 117.501 0.651 . . . . 0.0 112.122 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.5 tp -59.72 -32.95 71.01 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.096 -178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.2 pp -65.47 -36.47 77.75 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.38 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.68 -36.84 87.91 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 120.74 -0.743 . . . . 0.0 111.489 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 7.8 tt -56.42 -32.83 65.24 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 117.481 0.64 . . . . 0.0 111.156 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.84 -36.68 38.84 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 120.371 0.129 . . . . 0.0 111.28 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 53.5 mt -59.82 -42.03 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.175 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 39.4 t -70.91 -33.5 52.33 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.228 179.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.9 -35.48 71.1 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.73 -35.0 65.66 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 7.0 p -59.15 -31.83 46.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 119.989 -0.685 . . . . 0.0 111.389 -178.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.3 pp -58.96 -25.1 63.25 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.672 179.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 26.1 p -57.86 -40.38 80.02 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.052 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 14.7 tp -59.02 -31.43 68.82 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 120.523 -0.471 . . . . 0.0 109.786 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.7 t -81.09 -38.14 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.976 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -61.1 -8.55 3.52 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -178.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 3.0 ppt_? -81.76 -14.67 56.15 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 45.2 t -83.0 -36.18 12.78 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.262 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 21.2 ptt-85 -153.74 173.25 16.09 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.771 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.305 179.866 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.941 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 10.5 mp -118.76 136.15 54.13 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.662 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -141.98 152.29 43.31 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.072 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.3 tt -61.7 -39.84 92.9 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.141 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -26.27 62.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.618 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 19.1 tptt -70.49 -46.11 64.37 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-O 120.852 0.358 . . . . 0.0 111.182 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 64.1 m95 -71.82 -47.67 51.61 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.142 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.54 -39.3 83.51 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 120.305 -0.558 . . . . 0.0 111.608 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 20.5 t -58.4 -32.03 68.24 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.895 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.15 -25.01 65.18 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.211 179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -68.43 -3.11 10.2 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.915 -0.564 . . . . 0.0 112.24 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -74.85 -50.09 18.25 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 119.128 -1.029 . . . . 0.0 112.6 -178.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -104.96 -9.86 17.64 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 118.619 0.645 . . . . 0.0 111.798 177.2 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 1.5 t80 52.06 17.17 0.64 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 176.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -63.73 -52.74 59.13 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 675' ' ' ILE . . . . . 0.416 HD12 HG21 ' A' ' 675' ' ' ILE . 0.4 OUTLIER -68.38 -34.61 66.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 119.486 -0.886 . . . . 0.0 111.699 -178.384 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -33.78 71.02 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.121 -179.185 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.38 -46.79 87.68 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.153 -178.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -72.9 -46.46 52.54 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 96.2 mt -84.61 -19.74 32.51 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -174.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -83.91 13.57 4.81 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.728 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -130.7 -35.48 1.46 Allowed 'General case' 0 C--N 1.35 0.62 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.57 -36.77 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.057 178.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -60.18 -48.78 80.29 Favored 'General case' 0 C--N 1.349 0.553 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.14 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.32 -43.32 97.94 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -52.74 -27.67 18.78 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 38.7 mm -57.64 -51.57 68.32 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.236 -177.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 4.2 mp -61.77 -41.65 91.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.253 179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 90.6 mt -56.54 -40.34 67.81 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.438 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 57.5 t -67.12 -2.14 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 119.905 -0.718 . . . . 0.0 111.22 -177.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -73.99 -49.36 13.36 Favored Glycine 0 C--N 1.349 1.252 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 35.4 m -66.47 -22.48 66.2 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.925 178.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.79 -32.93 54.35 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.312 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 1.3 pp -80.58 -35.62 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.238 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.2 -45.5 95.9 Favored Glycine 0 C--N 1.342 0.911 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.6 tt -56.57 -42.17 78.17 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 -179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 54.0 mmt-85 -50.74 -33.92 24.99 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 122.702 0.401 . . . . 0.0 112.001 178.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 66.9 mt -56.95 -39.98 69.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.765 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 698' ' ' VAL . . . . . . . . . . . . . 17.1 m -55.48 -28.19 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 118.874 0.761 . . . . 0.0 110.787 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -57.95 -36.68 72.88 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.678 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.05 -50.44 73.72 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.931 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 7.6 p -67.2 -36.97 78.25 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.97 -25.75 67.07 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 1.3 m -57.97 -44.36 87.02 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 121.163 -0.215 . . . . 0.0 110.89 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 3.6 tt -73.24 -27.77 61.77 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.096 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 66.2 t -60.87 -29.47 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -60.75 -17.55 49.36 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.421 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 707' ' ' ARG . . . . . 0.44 ' CZ ' ' CZ ' ' C' ' 707' ' ' ARG . 0.0 OUTLIER -73.85 -34.72 64.63 Favored 'General case' 0 C--O 1.219 -0.521 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.799 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 22.0 t -82.82 -26.74 8.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.331 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 66.29 111.49 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 45.1 tp60 . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.414 179.875 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 8.1 mp -50.47 135.53 22.25 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 121.199 -0.2 . . . . 0.0 110.775 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -157.27 164.42 37.68 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 120.547 -0.461 . . . . 0.0 111.583 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.6 tt -56.08 -40.57 73.81 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.106 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -74.28 -29.41 61.65 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.041 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -61.11 -44.29 97.57 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.332 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -69.94 -51.14 35.29 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.8 -23.52 61.58 Favored 'General case' 0 C--O 1.217 -0.633 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 10.5 m -66.11 -31.78 72.84 Favored 'General case' 0 C--O 1.218 -0.582 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.368 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 4.7 mp -64.74 -22.03 66.89 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.788 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 24.5 m95 -68.7 -9.04 48.01 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -89.11 -47.64 7.96 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -103.14 -12.96 16.99 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 118.496 2.776 . . . . 0.0 118.496 -174.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -156.75 156.31 33.11 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 122.914 2.597 . . . . 0.0 117.309 -178.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -63.54 -29.42 70.69 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 112.583 -2.098 . . . . 0.0 112.274 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 7.2 tp -55.11 -27.0 18.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.58 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 11.7 m -58.59 -38.95 79.02 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.67 -36.2 70.56 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.381 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 34.9 t90 -55.79 -39.76 71.74 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 116.749 -0.205 . . . . 0.0 110.574 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.56 -14.99 59.97 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 16.8 t90 -101.84 -4.78 25.71 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -125.7 -2.25 7.29 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 120.328 -0.549 . . . . 0.0 112.108 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 7.1 tp -68.07 -40.39 83.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.999 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -60.35 -43.77 96.16 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.874 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 78.0 mt -68.2 -41.8 84.26 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.594 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -52.98 -28.65 24.84 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.544 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 686' ' ' ILE . . . . . . . . . . . . . 21.6 mm -59.32 -42.78 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.539 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.4 mt -58.3 -41.78 82.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 3.0 mp -62.05 -42.01 93.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 59.3 t -68.89 -0.99 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.324 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -104.93 7.09 44.33 Favored Glycine 0 CA--C 1.541 1.712 0 C-N-CA 120.634 -0.793 . . . . 0.0 111.902 179.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 3.2 m -88.53 -34.35 17.43 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 117.374 0.587 . . . . 0.0 111.348 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.3 -32.69 74.48 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.663 -178.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -57.26 -46.16 85.01 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.37 -178.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -71.2 -41.66 59.38 Favored Glycine 0 CA--C 1.532 1.111 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 178.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 10.5 tt -56.58 -34.9 67.61 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.595 -0.302 . . . . 0.0 111.438 179.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 11.7 mtm105 -50.69 -31.59 16.86 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 42.3 mm -59.62 -41.34 84.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.33 -28.66 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -56.03 -29.21 60.07 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 120.214 -0.594 . . . . 0.0 111.678 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -51.43 -35.92 41.54 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.776 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 79.7 t -60.43 -32.3 50.84 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.851 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.28 -25.82 67.81 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.257 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 23.2 t -57.44 -37.42 72.79 Favored 'General case' 0 C--O 1.22 -0.492 0 C-N-CA 121.14 -0.224 . . . . 0.0 111.24 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 26.0 tp -64.62 -31.47 72.71 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.029 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 22.0 t -88.1 -21.94 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.035 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.04 -25.78 67.16 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.754 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 68.1 mtp85 -73.7 -49.84 23.79 Favored 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 120.614 -0.434 . . . . 0.0 111.114 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 18.1 t -104.54 26.1 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.545 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -53.92 146.83 13.34 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.628 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.488 179.771 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 50.67 -176.0 0.02 OUTLIER 'General case' 0 C--O 1.215 -0.721 0 CA-C-O 120.615 0.245 . . . . 0.0 111.558 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -159.87 158.84 31.64 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -62.65 -40.73 97.96 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.245 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -74.53 -24.24 58.94 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.982 178.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -66.84 -39.5 87.63 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.12 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -60.25 -47.97 83.73 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.233 -0.587 . . . . 0.0 110.067 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.34 -29.35 70.39 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.73 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 19.3 t -64.41 -34.18 77.59 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.162 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 6.1 mp -68.68 -4.66 16.49 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -70.77 -28.81 64.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -62.63 -49.64 74.4 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.934 -177.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 672' ' ' TRP . . . . . 0.428 ' O ' ' N ' ' C' ' 674' ' ' ASP . 2.4 p90 -92.93 -22.67 19.08 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 115.635 1.717 . . . . 0.0 115.635 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 20.4 p90 43.28 8.86 0.0 OUTLIER 'General case' 0 C--N 1.359 1.015 0 N-CA-C 115.648 1.721 . . . . 0.0 115.648 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 674' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' C' ' 672' ' ' TRP . 9.2 t70 -64.24 -53.81 43.22 Favored 'General case' 0 C--N 1.349 0.586 0 CA-C-N 120.007 1.276 . . . . 0.0 110.63 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 7.8 tp -69.76 -33.22 55.22 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.718 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.243 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 13.4 m -58.85 -41.89 88.05 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -177.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -63.22 -43.66 97.47 Favored 'General case' 0 C--O 1.213 -0.829 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.297 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 3.1 t90 -72.51 -45.88 57.28 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.62 -27.03 55.57 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -92.93 7.91 42.0 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.52 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -137.51 3.68 2.56 Favored 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 120.507 -0.477 . . . . 0.0 111.858 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 3.9 tp -64.19 -41.89 93.81 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.063 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 4.6 ptt-85 -58.25 -43.45 87.87 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.159 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 82.5 mt -68.23 -39.87 81.82 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 177.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -53.39 -28.86 31.74 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.07 -179.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 24.0 mm -59.78 -44.29 93.6 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.518 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.843 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 54.7 mt -58.22 -41.51 81.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.539 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 31.3 mt -57.59 -41.86 80.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 31.2 t -67.96 -31.23 51.11 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 CA-C-O 119.021 -0.514 . . . . 0.0 111.736 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -67.08 -62.22 4.62 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 119.132 0.878 . . . . 0.0 111.001 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.3 m -51.63 -22.27 3.24 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 116.9 0.35 . . . . 0.0 111.405 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 tp -57.46 -32.85 67.36 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.127 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 1.2 pt -73.63 -24.86 20.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.392 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.81 -55.13 30.22 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.865 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 2.1 tt -56.83 -31.96 65.26 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 117.044 0.422 . . . . 0.0 111.945 -179.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 6.9 mmt180 -50.57 -34.34 25.34 Favored 'General case' 0 C--O 1.212 -0.885 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.66 -40.43 75.33 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 CA-C-O 118.688 -0.673 . . . . 0.0 112.427 -175.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 7.8 p -55.92 -29.2 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 CA-C-N 119.502 1.046 . . . . 0.0 111.185 -179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -56.71 -34.42 67.45 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.722 179.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.72 -35.25 63.47 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 119.294 -0.384 . . . . 0.0 111.573 -176.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.68 -32.16 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 120.001 -0.68 . . . . 0.0 109.836 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.26 -28.8 67.06 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.496 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.0 t -63.48 -38.41 91.04 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.364 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 15.0 tp -54.9 -30.98 59.59 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.083 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 41.3 t -75.44 -26.44 18.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.41 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -60.65 -16.93 43.99 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 707' ' ' ARG . . . . . 0.44 ' CZ ' ' CZ ' ' A' ' 707' ' ' ARG . 6.7 ptm180 -74.94 -32.38 61.73 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.276 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 35.4 t -82.79 -30.1 8.69 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.187 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 11.5 tpt85 55.13 -85.71 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.916 0 CA-C-O 119.264 -0.398 . . . . 0.0 111.958 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 . . . . . 0 C--N 1.346 0.426 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.455 -179.615 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.783 HD11 ' CZ2' ' A' ' 666' ' ' TRP . 12.1 tp -171.22 144.93 2.12 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.339 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -161.59 148.85 14.6 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.261 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.816 HD13 ' N ' ' A' ' 664' ' ' ASP . 0.0 OUTLIER -54.73 -19.73 6.89 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.584 179.156 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 664' ' ' ASP . . . . . 0.816 ' N ' HD13 ' A' ' 663' ' ' LEU . 9.3 t70 -75.1 -37.56 61.45 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.314 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -68.94 -39.6 79.48 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.784 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 666' ' ' TRP . . . . . 0.783 ' CZ2' HD11 ' A' ' 661' ' ' LEU . 75.4 m95 -68.24 -49.74 58.65 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.263 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.42 -40.58 77.17 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.128 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 26.1 t -60.93 -35.69 77.37 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.846 178.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.402 HD22 ' CG2' ' A' ' 675' ' ' ILE . 6.6 mt -57.58 -19.88 28.62 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.331 179.033 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -68.64 -2.84 9.99 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -64.24 -48.94 73.89 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.37 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.6 -23.12 13.51 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.409 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 54.37 1.71 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -63.92 -53.53 48.9 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 119.217 0.917 . . . . 0.0 111.722 -179.193 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.516 HD11 ' CE3' ' A' ' 678' ' ' TRP . 8.8 tp -69.28 -32.11 52.35 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.27 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 18.5 m -58.5 -39.13 79.2 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.951 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -60.35 -41.17 93.06 Favored 'General case' 0 C--O 1.211 -0.923 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.516 ' CE3' HD11 ' A' ' 675' ' ' ILE . 76.5 t90 -71.97 -22.16 61.48 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.974 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.96 -16.46 35.75 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.69 26.44 5.59 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 119.963 -0.695 . . . . 0.0 112.329 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -130.37 -41.14 1.24 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 10.6 tt -66.53 -36.97 78.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.999 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -48.38 76.78 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 36.9 mt -60.19 -37.45 73.43 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.899 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.472 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.2 OUTLIER -52.11 -28.71 18.72 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.861 -178.032 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.718 HD11 ' CG2' ' C' ' 686' ' ' ILE . 1.4 mp -58.68 -50.52 78.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.948 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 58.1 mt -58.22 -42.01 82.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.592 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 88.5 mt -58.88 -41.17 82.1 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 685' ' ' PHE . 92.3 t -67.37 -17.96 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.018 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.13 -65.04 3.54 Favored Glycine 0 C--N 1.35 1.328 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 178.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 48.7 m -54.51 -29.51 50.63 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.772 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.9 tp -55.75 -41.77 74.45 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.926 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.629 HD12 ' HG3' ' B' ' 696' ' ' ARG . 0.3 OUTLIER -71.03 -37.08 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.114 -179.255 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.73 -40.6 98.68 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 110.124 -1.191 . . . . 0.0 110.124 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 695' ' ' LEU . 3.2 tt -56.44 -31.66 64.15 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-O 120.655 0.265 . . . . 0.0 111.549 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 42.1 mmt-85 -50.45 -34.56 25.2 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 697' ' ' ILE . . . . . 0.511 HD12 ' N ' ' A' ' 698' ' ' VAL . 2.4 pp -57.48 -40.38 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -175.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 695' ' ' LEU . 18.9 m -55.81 -28.33 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 119.263 -0.975 . . . . 0.0 110.965 -178.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -55.65 -36.27 66.85 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.038 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.85 -47.64 79.9 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 63.1 t -66.04 -44.54 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 702' ' ' LEU . . . . . 0.547 ' O ' HG12 ' A' ' 705' ' ' VAL . 5.8 tt -62.85 -29.51 70.8 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.928 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 35.4 t -64.41 -42.66 95.96 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.9 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.482 HD11 ' HD3' ' C' ' 707' ' ' ARG . 7.6 tp -80.1 -30.03 39.11 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.072 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.547 HG12 ' O ' ' A' ' 702' ' ' LEU . 0.5 OUTLIER -60.77 -22.67 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.542 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -60.72 -24.68 65.86 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.665 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -73.7 -11.59 60.45 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.038 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 61.9 t -107.34 -36.13 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.096 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 53.6 ttm-85 -127.91 145.62 50.89 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.65 -179.836 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 N--CA 1.497 1.914 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.678 HD21 ' CD1' ' A' ' 666' ' ' TRP . 1.2 pt? -162.84 150.61 13.66 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -167.44 -175.87 3.02 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.442 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.454 HD21 HD13 ' C' ' 660' ' ' LEU . 10.6 tt -53.55 -40.14 65.3 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.501 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -74.35 -30.63 62.09 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.481 0.488 . . . . 0.0 112.044 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 5.4 tptp -70.37 -46.36 64.23 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -66.92 -39.64 87.42 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.366 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.25 -23.36 67.03 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.742 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -31.97 73.21 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.533 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 61.1 mt -77.45 -4.22 44.33 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 10.7 m0 -68.62 -5.19 18.63 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -89.11 -49.78 6.55 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 119.208 -0.997 . . . . 0.0 111.238 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 672' ' ' TRP . . . . . 0.423 ' O ' ' N ' ' B' ' 674' ' ' ASP . 1.2 p90 -104.27 -23.62 13.21 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.918 177.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 53.6 p90 34.5 25.73 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.401 1.259 . . . . 0.0 114.401 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 674' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' B' ' 672' ' ' TRP . 72.5 m-20 -63.65 -53.08 56.98 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 119.786 -0.765 . . . . 0.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tp -69.1 -31.58 50.72 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.05 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.1 m -58.8 -36.4 74.4 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.681 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -60.49 -45.9 92.06 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.595 -0.442 . . . . 0.0 109.817 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -70.83 -45.97 63.58 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.534 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 75.6 mt -67.35 -2.79 6.66 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 119.939 -0.704 . . . . 0.0 111.795 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.3 t90 -117.69 142.78 46.85 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 72.6 13.27 5.34 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -36.35 61.16 Favored 'Isoleucine or valine' 0 C--N 1.354 0.764 0 CA-C-N 119.585 1.084 . . . . 0.0 110.419 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.8 mtm105 -55.43 -43.76 75.65 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.904 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 88.2 mt -60.45 -42.75 92.28 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.753 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -55.81 -43.78 77.24 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.32 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.502 HG21 HD11 ' C' ' 686' ' ' ILE . 1.9 mp -59.75 -40.52 82.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 120.267 -0.573 . . . . 0.0 109.644 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 90.8 mt -58.77 -41.53 82.83 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.482 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 26.0 mm -58.75 -43.94 89.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 61.3 t -68.45 -9.51 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.161 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -78.08 -39.1 24.55 Favored Glycine 0 C--N 1.351 1.389 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 16.5 m -80.9 -19.83 43.49 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.802 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.82 -40.93 94.58 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.901 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.57 HD11 ' HG2' ' C' ' 696' ' ' ARG . 0.8 OUTLIER -60.19 -40.4 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.579 -179.007 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -68.3 -43.66 78.3 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 119.566 -1.302 . . . . 0.0 111.238 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.492 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.2 OUTLIER -56.92 -38.54 73.02 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 116.906 0.353 . . . . 0.0 111.481 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.629 ' HG3' HD12 ' A' ' 693' ' ' ILE . 25.4 mmt180 -50.77 -30.17 13.4 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 44.8 mm -58.24 -39.85 75.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 119.435 -0.317 . . . . 0.0 111.225 -176.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.658 ' O ' HG22 ' B' ' 701' ' ' VAL . 6.4 p -54.97 -26.95 18.33 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 C-N-CA 120.614 -0.435 . . . . 0.0 111.007 -179.132 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -54.29 -24.8 20.41 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.57 -34.9 18.93 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 121.337 -0.145 . . . . 0.0 111.092 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 701' ' ' VAL . . . . . 0.658 HG22 ' O ' ' B' ' 698' ' ' VAL . 35.2 m -59.33 -31.34 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.55 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 702' ' ' LEU . . . . . 0.487 HD23 ' C ' ' B' ' 702' ' ' LEU . 8.9 tt -58.24 -41.62 84.58 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.592 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 26.7 t -64.82 -37.55 87.99 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -55.28 -43.98 75.26 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -176.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 27.1 m -71.1 -10.8 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 120.022 -0.671 . . . . 0.0 112.676 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.58 -14.05 17.81 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 119.427 -0.909 . . . . 0.0 110.84 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -73.95 -24.04 59.59 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 121.281 -0.167 . . . . 0.0 111.171 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 40.2 t -85.28 -36.07 10.58 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.275 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -68.64 -176.38 0.8 Allowed 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.498 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 118.004 -0.998 . . . . 0.0 111.067 179.855 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.454 HD13 HD21 ' B' ' 663' ' ' LEU . 17.7 mt . . . . . 0 N--CA 1.494 1.757 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -85.12 121.87 28.51 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.152 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -162.42 161.43 27.24 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.382 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 8.8 tt -52.91 -40.5 63.62 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.133 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -62.98 -31.87 73.08 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 123.834 0.709 . . . . 0.0 111.616 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -69.79 -41.17 75.44 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.047 -179.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -61.92 -49.33 76.61 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.449 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.54 -31.87 72.86 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.431 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 7.6 t -67.88 -32.68 73.33 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.604 0.24 . . . . 0.0 111.184 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 669' ' ' LEU . . . . . 0.545 HD11 HG22 ' C' ' 675' ' ' ILE . 11.2 tp -57.66 -15.86 8.93 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.284 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -68.7 -2.61 9.63 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 118.981 -0.533 . . . . 0.0 112.35 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -65.03 -50.39 66.45 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 119.318 -0.953 . . . . 0.0 112.995 -177.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 672' ' ' TRP . . . . . 0.411 ' CE3' ' HB2' ' C' ' 674' ' ' ASP . 12.9 p-90 -103.81 6.17 36.45 Favored 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 56.6 -29.39 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 118.943 2.942 . . . . 0.0 118.943 175.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 674' ' ' ASP . . . . . 0.411 ' HB2' ' CE3' ' C' ' 672' ' ' TRP . 0.3 OUTLIER -63.61 -54.6 33.38 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 121.519 1.963 . . . . 0.0 113.336 -175.015 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.657 HG23 HD23 ' C' ' 679' ' ' LEU . 1.6 mm -69.75 -27.77 34.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 119.119 -1.032 . . . . 0.0 110.113 177.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 18.8 m -58.55 -49.82 76.03 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -70.15 -42.79 72.08 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -69.19 -26.48 64.86 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.657 HD23 HG23 ' C' ' 675' ' ' ILE . 0.7 OUTLIER -69.69 -32.93 71.82 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -178.388 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -126.58 18.43 7.44 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 114.495 1.295 . . . . 0.0 114.495 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -125.28 0.27 7.73 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.98 177.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 7.0 tp -68.56 -36.16 73.42 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 120.599 0.237 . . . . 0.0 111.524 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.07 -37.14 66.38 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.026 -0.533 . . . . 0.0 112.125 -176.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.416 ' N ' HD12 ' C' ' 684' ' ' ILE . 1.8 mp -63.95 -48.66 85.11 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.828 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -59.22 -30.13 68.02 Favored 'General case' 0 C--O 1.218 -0.575 0 O-C-N 123.387 0.429 . . . . 0.0 111.093 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.718 ' CG2' HD11 ' A' ' 686' ' ' ILE . 1.0 OUTLIER -58.89 -46.0 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.116 -179.272 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 63.8 mt -60.17 -41.68 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.823 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.567 ' H ' HD12 ' C' ' 688' ' ' ILE . 3.5 mp -57.05 -40.89 75.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.198 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 51.2 t -66.95 -17.6 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 119.844 -0.742 . . . . 0.0 111.431 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -70.32 -62.8 3.52 Favored Glycine 0 C--N 1.351 1.384 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.05 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 4.5 m -51.85 -25.39 7.77 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 117.365 0.583 . . . . 0.0 112.01 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.4 tp -53.77 -34.3 58.62 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.001 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.455 ' C ' HD12 ' C' ' 693' ' ' ILE . 1.7 pp -79.18 -33.32 15.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.787 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.937 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.92 -48.54 85.11 Favored Glycine 0 CA--C 1.543 1.795 0 C-N-CA 120.68 -0.771 . . . . 0.0 111.691 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.549 ' C ' HD13 ' C' ' 695' ' ' LEU . 1.2 tm? -56.57 -31.84 64.62 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -178.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.57 ' HG2' HD11 ' B' ' 693' ' ' ILE . 0.4 OUTLIER -50.5 -34.19 24.17 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.78 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 20.0 tt -57.64 -41.22 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-O 118.639 -0.696 . . . . 0.0 112.681 -174.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.661 ' O ' HG22 ' C' ' 701' ' ' VAL . 5.6 p -56.49 -28.87 27.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.028 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -34.84 69.7 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.303 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.75 -34.83 63.05 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -175.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 701' ' ' VAL . . . . . 0.661 HG22 ' O ' ' C' ' 698' ' ' VAL . 35.4 m -59.15 -31.24 45.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.459 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tt -58.64 -27.89 65.15 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.834 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 19.6 m -58.43 -38.33 77.21 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.497 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 14.2 tp -59.43 -35.23 73.64 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.441 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 9.9 t -84.9 -17.87 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.289 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.24 -25.92 66.02 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 707' ' ' ARG . . . . . 0.482 ' HD3' HD11 ' A' ' 704' ' ' LEU . 34.2 mtm105 -73.85 -45.78 48.99 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.96 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 45.3 t -88.61 -12.59 10.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.254 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.508 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.416 HD12 HD11 ' C' ' 663' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.842 0 CA-C-O 119.695 -0.193 . . . . 0.0 110.96 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.478 ' N ' HD12 ' A' ' 661' ' ' LEU . 7.6 mp 55.88 177.87 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.527 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -169.92 147.7 3.36 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.269 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.1 tt -61.65 -40.24 94.21 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.528 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -73.98 -23.95 59.54 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.491 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 15.2 tmtt? -64.88 -42.16 95.03 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 121.059 -0.257 . . . . 0.0 111.136 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 666' ' ' TRP . . . . . 0.565 ' HE1' HD22 ' B' ' 661' ' ' LEU . 91.5 m95 -69.1 -53.27 21.15 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.328 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.55 84.89 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.875 -178.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 40.4 t -58.75 -31.77 68.63 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.743 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 679' ' ' LEU . 47.7 tp -58.73 -25.68 63.19 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.306 -178.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -68.29 -5.55 19.18 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 119.045 -1.062 . . . . 0.0 111.429 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -63.1 -40.31 97.27 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.972 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 672' ' ' TRP . . . . . 0.447 ' HB2' HG22 ' A' ' 675' ' ' ILE . 6.5 m95 -83.42 -22.75 32.59 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.591 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 42.9 t80 64.99 -67.25 0.12 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -56.04 -52.73 63.2 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.584 HD13 ' O ' ' A' ' 675' ' ' ILE . 0.3 OUTLIER -68.58 -28.42 40.13 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.767 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.477 -179.951 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.0 m -58.97 -46.39 88.18 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.882 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -62.35 -47.38 84.48 Favored 'General case' 0 C--O 1.213 -0.824 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.737 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -64.88 -37.46 87.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.784 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.407 HD23 ' CD2' ' A' ' 669' ' ' LEU . 8.5 tp -67.98 -8.86 40.88 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.328 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.3 t-105 -139.3 0.86 1.94 Allowed 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -102.5 0.42 33.59 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 119.889 -0.724 . . . . 0.0 112.125 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.619 HD12 ' N ' ' A' ' 683' ' ' ARG . 2.8 pp -55.93 -36.84 45.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.628 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.283 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.619 ' N ' HD12 ' A' ' 682' ' ' ILE . 2.1 tmm_? -67.48 -48.51 66.93 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.946 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 86.3 mt -62.74 -43.67 98.87 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.921 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -52.81 -29.07 25.52 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.781 -179.034 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.698 HG13 HD12 ' B' ' 686' ' ' ILE . 16.9 mm -58.69 -38.97 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.923 -179.189 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 10.8 mt -58.01 -41.75 81.08 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 80.8 mt -56.99 -41.28 77.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 177.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 689' ' ' VAL . 43.3 t -68.04 -0.35 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.345 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -81.1 -34.92 25.42 Favored Glycine 0 C--N 1.349 1.272 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 178.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 13.3 m -75.81 -30.74 59.14 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 116.889 0.345 . . . . 0.0 111.101 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.79 -33.12 54.97 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.944 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 1.7 pp -70.58 -37.23 69.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 120.101 -0.64 . . . . 0.0 110.033 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 694' ' ' GLY . . . . . 0.679 ' O ' HG22 ' A' ' 697' ' ' ILE . . . -59.81 -43.27 98.09 Favored Glycine 0 C--O 1.214 -1.095 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.791 ' O ' HG22 ' A' ' 698' ' ' VAL . 0.2 OUTLIER -56.7 -42.19 78.7 Favored 'General case' 0 C--O 1.211 -0.953 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.553 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -50.48 -35.25 28.24 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 697' ' ' ILE . . . . . 0.694 HD13 ' O ' ' A' ' 697' ' ' ILE . 0.2 OUTLIER -58.18 -40.19 76.37 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.77 -177.093 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.791 HG22 ' O ' ' A' ' 695' ' ' LEU . 13.2 m -55.82 -28.35 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 118.384 0.538 . . . . 0.0 110.829 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -58.45 -36.54 73.84 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.651 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.9 -50.81 72.06 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.175 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 698' ' ' VAL . 11.1 p -68.83 -32.08 53.29 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.18 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.0 tp -58.77 -27.36 64.91 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.223 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 48.3 t -58.0 -45.32 87.03 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.423 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.3 -40.97 97.02 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.92 -28.39 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.435 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -60.81 -14.8 24.03 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -39.72 63.84 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.435 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.535 HG12 ' O ' ' A' ' 708' ' ' VAL . 28.5 t -105.54 10.43 9.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.532 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 66.54 -76.07 0.05 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 122.237 -0.29 . . . . 0.0 110.531 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.468 179.924 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.423 HD23 ' N ' ' B' ' 661' ' ' LEU . 1.4 tt . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.565 HD22 ' HE1' ' A' ' 666' ' ' TRP . 0.7 OUTLIER 54.13 90.61 0.03 OUTLIER 'General case' 0 C--O 1.22 -0.461 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.933 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -143.79 147.52 34.26 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.398 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.6 ' C ' HD22 ' B' ' 663' ' ' LEU . 0.0 OUTLIER -52.92 -27.4 18.57 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.463 -179.608 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 664' ' ' ASP . . . . . 0.581 ' H ' HD13 ' B' ' 663' ' ' LEU . 1.3 t70 -74.23 -40.62 62.3 Favored 'General case' 0 C--O 1.22 -0.487 0 O-C-N 123.275 0.359 . . . . 0.0 111.147 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -65.26 -46.09 81.91 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.393 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -64.92 -43.86 91.4 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 120.779 -0.369 . . . . 0.0 111.005 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 667' ' ' ALA . . . . . 0.666 ' HB2' HD23 ' C' ' 660' ' ' LEU . . . -63.28 -31.0 72.04 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.311 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 34.4 t -55.62 -31.45 62.29 Favored 'General case' 0 C--O 1.219 -0.502 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.892 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.54 HD23 HG23 ' B' ' 675' ' ' ILE . 11.2 mp -71.44 -8.77 56.01 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -74.17 -26.79 60.5 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -63.01 -43.8 97.77 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.563 -178.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.22 -23.17 13.64 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.699 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 14.6 t80 50.42 6.27 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 178.058 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -63.66 -53.84 45.1 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 119.578 1.081 . . . . 0.0 110.992 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.54 HG23 HD23 ' B' ' 669' ' ' LEU . 7.0 tp -69.67 -29.83 42.65 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.911 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.844 177.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 13.1 m -59.04 -41.24 87.37 Favored 'General case' 0 C--O 1.214 -0.809 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.716 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -62.64 -47.35 84.1 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.268 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.453 ' O ' HG23 ' B' ' 682' ' ' ILE . 3.0 t90 -72.47 -45.48 59.34 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.369 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 8.3 tp -74.47 -29.38 61.42 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 19.1 t90 -86.77 -14.82 41.22 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 120.152 -0.619 . . . . 0.0 112.016 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -103.94 10.81 36.11 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.238 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.453 HG23 ' O ' ' B' ' 678' ' ' TRP . 30.9 pt -62.64 -41.27 91.55 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.3 ttp-105 -63.69 -45.55 89.53 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.749 -0.381 . . . . 0.0 110.734 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.0 -40.08 82.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.526 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.7 OUTLIER -53.38 -30.93 42.32 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.473 -179.229 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.698 HD12 HG13 ' A' ' 686' ' ' ILE . 22.5 mm -59.8 -50.06 81.48 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.136 -179.443 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 73.7 mt -62.12 -42.15 93.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 79.6 mt -60.8 -42.67 93.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.657 ' O ' HD11 ' B' ' 692' ' ' LEU . 87.0 t -68.73 -1.67 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.405 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -105.84 6.71 41.02 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.624 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 38.6 m -88.7 -34.27 17.25 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 117.414 0.607 . . . . 0.0 111.583 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.657 HD11 ' O ' ' B' ' 689' ' ' VAL . 0.2 OUTLIER -61.07 -35.12 76.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.417 -178.669 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.738 ' O ' HD13 ' B' ' 693' ' ' ILE . 0.0 OUTLIER -61.48 -33.54 57.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.956 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 694' ' ' GLY . . . . . 0.641 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -73.05 -44.06 37.67 Favored Glycine 0 C--O 1.214 -1.103 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 178.017 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.75 -41.62 77.87 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 121.323 -0.151 . . . . 0.0 110.836 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 28.0 mmt180 -51.03 -31.3 17.93 Favored 'General case' 0 C--O 1.214 -0.773 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.678 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.2 OUTLIER -59.53 -40.68 82.57 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.26 -177.763 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 54.0 t -56.04 -28.21 24.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 119.551 -0.261 . . . . 0.0 110.889 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -55.44 -26.82 44.27 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 120.023 -0.671 . . . . 0.0 111.276 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -53.12 -36.82 61.18 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 120.639 -0.424 . . . . 0.0 109.943 178.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.57 -43.15 98.13 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.534 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.7 tt -63.33 -40.69 98.01 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.578 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.4 t -60.36 -32.75 71.57 Favored 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.287 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.86 -40.19 94.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.86 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.76 -19.5 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.684 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -60.85 -17.72 51.78 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.718 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 8.6 tpp85 -73.9 -41.43 62.13 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 46.1 t -92.21 -36.25 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.152 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 18.8 ttm105 -142.74 151.74 41.59 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.945 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.034 -0.984 . . . . 0.0 111.131 179.871 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.666 HD23 ' HB2' ' B' ' 667' ' ' ALA . 5.2 mp . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.501 HD11 ' HE1' ' C' ' 666' ' ' TRP . 0.3 OUTLIER -85.86 121.01 27.9 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.216 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 662' ' ' GLU . . . . . 0.47 ' N ' HD13 ' C' ' 661' ' ' LEU . 38.6 tt0 -161.25 162.64 31.18 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.079 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.416 HD11 HD12 ' A' ' 660' ' ' LEU . 9.3 tt -58.03 -40.03 79.84 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.538 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -74.01 -23.95 59.51 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.511 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -44.36 76.08 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.232 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 666' ' ' TRP . . . . . 0.501 ' HE1' HD11 ' C' ' 661' ' ' LEU . 86.5 m95 -62.67 -49.98 72.98 Favored 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 120.671 -0.412 . . . . 0.0 111.087 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.0 -30.56 59.7 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.509 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.8 m -61.59 -32.32 72.42 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.454 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 669' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' C' ' 669' ' ' LEU . 4.5 mm? -67.32 -8.83 35.42 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -68.63 -22.39 64.42 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.758 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.09 -42.65 99.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 672' ' ' TRP . . . . . 0.531 ' HB2' HG22 ' C' ' 675' ' ' ILE . 2.6 m95 -80.02 -22.75 42.06 Favored 'General case' 0 CA--C 1.558 1.269 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -176.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 63.27 -69.4 0.07 Allowed 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 120.068 1.304 . . . . 0.0 114.204 178.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -50.9 -52.37 42.55 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -176.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.531 HG22 ' HB2' ' C' ' 672' ' ' TRP . 7.3 tp -68.56 -28.49 40.44 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.006 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.6 m -58.81 -43.76 90.64 Favored 'General case' 0 C--O 1.22 -0.475 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.167 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -60.36 -47.02 87.84 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 120.326 -0.549 . . . . 0.0 109.8 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 41.8 t90 -57.55 -41.34 80.81 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.135 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 53.4 mt -73.62 -19.67 60.8 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -112.57 1.8 15.97 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -120.74 -7.9 9.53 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.542 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 8.0 tp -58.51 -36.62 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.998 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 49.3 ttp180 -55.8 -48.2 75.8 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.455 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.456 ' N ' HD12 ' C' ' 684' ' ' ILE . 2.0 mp -67.77 -46.75 81.85 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.572 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.411 ' O ' HG23 ' C' ' 689' ' ' VAL . 5.8 m-85 -52.74 -30.03 30.3 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 123.248 0.343 . . . . 0.0 111.067 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.528 HG23 HD11 ' A' ' 686' ' ' ILE . 1.0 OUTLIER -58.82 -45.79 91.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.496 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 52.7 mt -62.74 -41.65 93.21 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.453 HD12 ' N ' ' C' ' 688' ' ' ILE . 2.1 mp -56.49 -40.89 70.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.737 ' O ' HD12 ' C' ' 692' ' ' LEU . 87.2 t -66.81 -22.17 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.899 -176.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.02 -5.43 87.66 Favored Glycine 0 CA--C 1.555 2.568 0 CA-C-N 119.93 1.241 . . . . 0.0 113.34 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 67.4 m -88.76 -34.5 17.1 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.97 1.385 . . . . 0.0 113.046 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 692' ' ' LEU . . . . . 0.852 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -53.85 -31.68 50.39 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.049 -178.788 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.852 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.2 OUTLIER -62.05 -33.87 60.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 178.904 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.73 -37.14 89.3 Favored Glycine 0 CA--C 1.54 1.626 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.496 ' O ' HG23 ' C' ' 698' ' ' VAL . 4.1 tt -56.39 -30.85 63.25 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -49.42 -36.3 21.78 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.517 HD12 ' N ' ' C' ' 698' ' ' VAL . 2.2 pp -59.89 -41.92 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.964 0.802 . . . . 0.0 112.609 -177.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.717 ' O ' HG22 ' C' ' 701' ' ' VAL . 0.0 OUTLIER -61.61 -28.85 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 118.523 -1.271 . . . . 0.0 110.282 -179.293 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 699' ' ' PHE . . . . . 0.406 ' O ' HD23 ' C' ' 702' ' ' LEU . 1.0 OUTLIER -64.45 -35.54 81.26 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -179.331 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.68 -35.48 66.08 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -176.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 701' ' ' VAL . . . . . 0.717 HG22 ' O ' ' C' ' 698' ' ' VAL . 34.1 m -59.77 -31.52 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 120.063 -0.655 . . . . 0.0 111.515 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 702' ' ' LEU . . . . . 0.406 HD23 ' O ' ' C' ' 699' ' ' PHE . 1.5 pp -58.47 -28.77 65.63 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.178 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.3 m -58.04 -41.42 83.22 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.337 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 24.9 tp -62.23 -33.56 74.82 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 23.0 t -69.87 -27.25 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.609 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -60.94 -7.01 2.11 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 64.0 ttt-85 -73.81 -42.51 60.81 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 3.1 t -102.68 26.08 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.673 179.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.687 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.694 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 45.9 mt . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.34 -155.93 0.2 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.083 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 78.25 168.6 0.21 Allowed 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 117.961 0.346 . . . . 0.0 110.706 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 3.4 tt -52.3 -22.57 4.64 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.204 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -69.47 -45.54 68.77 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.322 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -70.4 -41.33 73.15 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.7 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 666' ' ' TRP . . . . . 0.664 ' CD1' HD13 ' B' ' 661' ' ' LEU . 77.2 m95 -64.56 -38.8 92.27 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.116 -179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.33 78.82 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 120.293 -0.563 . . . . 0.0 112.487 -178.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 11.5 t -57.39 -32.6 66.98 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.144 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.468 HD11 ' CG2' ' A' ' 675' ' ' ILE . 15.3 tp -58.76 -23.1 59.47 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.177 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -79.22 -2.99 43.62 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 118.274 -0.87 . . . . 0.0 112.954 -177.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.23 -50.68 37.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 117.987 -1.485 . . . . 0.0 111.906 -177.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -104.9 -22.13 13.2 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-O 120.714 0.292 . . . . 0.0 110.546 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 47.9 p90 40.22 23.28 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 178.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -62.81 -52.68 62.23 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.51 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.468 ' CG2' HD11 ' A' ' 669' ' ' LEU . 7.4 tp -68.59 -27.35 35.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.685 178.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 25.8 m -58.03 -36.15 72.32 Favored 'General case' 0 C--N 1.347 0.483 0 C-N-CA 120.367 -0.533 . . . . 0.0 109.719 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -59.94 -47.5 85.56 Favored 'General case' 0 C--O 1.219 -0.5 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 177.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.461 ' O ' HG22 ' A' ' 682' ' ' ILE . 76.6 t90 -61.73 -19.86 62.88 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.224 177.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.5 tp -94.03 -8.5 39.68 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 120.362 -0.535 . . . . 0.0 112.011 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -128.33 21.38 6.16 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 120.367 -0.533 . . . . 0.0 112.123 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -132.41 -40.24 1.0 Allowed 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 178.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.566 ' O ' HD13 ' A' ' 682' ' ' ILE . 0.0 OUTLIER -68.07 -38.77 80.34 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.744 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.242 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -59.28 -48.17 82.61 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.528 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -62.06 -45.61 98.35 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.61 ' HA ' HD12 ' A' ' 688' ' ' ILE . 1.0 OUTLIER -52.72 -27.56 18.15 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 179.569 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.82 HG23 HG12 ' C' ' 686' ' ' ILE . 32.7 mm -57.33 -50.52 76.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 C-N-CA 120.161 -0.616 . . . . 0.0 110.581 -177.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 44.0 mt -58.94 -42.03 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 119.614 -0.834 . . . . 0.0 109.854 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 688' ' ' ILE . . . . . 0.61 HD12 ' HA ' ' A' ' 685' ' ' PHE . 81.8 mt -56.65 -40.91 72.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.483 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 88.8 t -67.25 -16.02 20.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.864 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -72.32 -26.4 72.11 Favored Glycine 0 CA--C 1.539 1.542 0 N-CA-C 110.087 -1.205 . . . . 0.0 110.087 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -86.33 -19.84 29.22 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.671 0.236 . . . . 0.0 111.094 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.39 -40.9 88.08 Favored 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.266 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.763 HD13 ' O ' ' A' ' 693' ' ' ILE . 0.1 OUTLIER -68.53 -33.89 62.48 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.185 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -68.0 -43.22 82.92 Favored Glycine 0 C--O 1.213 -1.203 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.676 HD23 ' O ' ' A' ' 695' ' ' LEU . 4.5 tt -55.96 -31.45 62.99 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-O 121.071 0.462 . . . . 0.0 110.697 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.416 ' HG2' HD11 ' C' ' 693' ' ' ILE . 2.7 tpp180 -50.34 -35.28 27.09 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.35 -40.49 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 695' ' ' LEU . 10.8 m -55.79 -28.02 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 119.5 -0.88 . . . . 0.0 111.204 -177.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -55.28 -36.82 66.55 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.644 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.1 -48.92 77.44 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 88.4 t -65.65 -39.73 85.82 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 702' ' ' LEU . . . . . 0.407 ' HA ' HG12 ' A' ' 705' ' ' VAL . 7.2 tt -60.9 -33.1 72.6 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.701 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 21.7 t -64.29 -45.22 88.96 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.208 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 16.5 tp -81.23 -34.09 32.4 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 702' ' ' LEU . 1.8 p -60.87 -18.67 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.697 -178.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.26 -12.51 56.76 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 -73.78 -38.58 64.61 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.381 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 2.8 m -95.87 23.53 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.135 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 29.6 ttm180 -96.94 -59.16 1.86 Allowed 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 117.825 -1.084 . . . . 0.0 110.095 179.842 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.505 ' C ' HD12 ' B' ' 661' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.664 HD13 ' CD1' ' A' ' 666' ' ' TRP . 6.7 mp -125.64 92.33 3.58 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.217 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -140.09 160.89 38.93 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.295 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.73 -39.94 68.77 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.688 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -72.63 -32.23 65.75 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.848 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -46.2 64.62 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -72.81 -32.53 65.6 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.383 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.77 -38.12 79.83 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.676 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 26.5 t -59.63 -32.39 70.39 Favored 'General case' 0 C--O 1.218 -0.602 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.817 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 7.9 mt -57.57 -19.41 25.39 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.94 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -68.69 -2.88 10.22 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 119.909 -0.716 . . . . 0.0 112.511 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -81.39 -49.43 10.67 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.918 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.1 p90 -104.23 -23.08 13.29 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.516 177.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 49.7 p90 38.05 25.33 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 178.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -63.63 -53.59 49.02 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.606 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 5.8 tp -69.17 -41.22 81.26 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.394 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.2 m -59.01 -50.57 73.58 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.586 -178.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -65.52 -33.39 75.81 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 120.061 -0.655 . . . . 0.0 111.029 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.454 ' O ' HG12 ' B' ' 682' ' ' ILE . 15.1 t-105 -72.13 -47.12 53.45 Favored 'General case' 0 C--O 1.209 -1.058 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.481 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 679' ' ' LEU . . . . . 0.676 HD22 HG13 ' B' ' 682' ' ' ILE . 0.2 OUTLIER -86.43 -17.14 35.07 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -176.857 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 4.2 t90 -69.49 0.72 4.83 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.718 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -126.71 -17.19 5.06 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.676 HG13 HD22 ' B' ' 679' ' ' LEU . 49.3 mm -59.34 -46.21 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 119.113 -0.47 . . . . 0.0 112.049 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 7.4 ptt-85 -56.51 -44.04 80.35 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.222 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 86.4 mt -67.73 -42.92 86.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.604 ' HA ' HD12 ' B' ' 688' ' ' ILE . 0.3 OUTLIER -53.26 -28.18 26.31 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.989 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.701 HG21 HD11 ' C' ' 686' ' ' ILE . 29.9 mm -58.15 -49.7 80.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 C-N-CA 120.864 -0.335 . . . . 0.0 111.132 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 49.9 mt -57.57 -41.73 79.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 688' ' ' ILE . . . . . 0.604 HD12 ' HA ' ' B' ' 685' ' ' PHE . 61.3 mt -58.1 -42.06 82.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.204 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.485 ' O ' HG12 ' B' ' 689' ' ' VAL . 57.4 t -68.61 -3.04 2.29 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.17 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.013 -179.358 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.92 -36.83 10.79 Favored Glycine 0 C--N 1.346 1.096 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.54 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 71.0 m -75.09 -27.04 59.73 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 117.077 0.439 . . . . 0.0 111.045 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 mp -53.5 -32.22 49.41 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.982 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 1.6 pp -74.7 -38.17 44.35 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.712 0 C-N-CA 119.886 -0.725 . . . . 0.0 111.155 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.47 -55.24 28.57 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.584 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.709 ' C ' HD22 ' B' ' 695' ' ' LEU . 0.0 OUTLIER -56.56 -28.32 59.9 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 117.298 0.549 . . . . 0.0 111.988 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.518 ' HE ' HD11 ' A' ' 693' ' ' ILE . 0.2 OUTLIER -46.68 -28.49 1.5 Allowed 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 123.022 0.529 . . . . 0.0 112.089 -177.261 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 6.9 tp -57.33 -39.17 66.31 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.217 0 CA-C-O 118.958 -0.544 . . . . 0.0 111.553 -177.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.674 HG22 ' O ' ' B' ' 695' ' ' LEU . 28.7 m -54.88 -28.28 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-N 119.124 0.875 . . . . 0.0 111.548 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -55.21 -25.8 35.34 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -50.5 -50.16 53.63 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.503 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 701' ' ' VAL . . . . . 0.494 HG22 ' O ' ' B' ' 698' ' ' VAL . 31.0 m -68.03 -32.06 54.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.646 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.1 tt -63.46 -26.97 68.97 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.586 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 40.2 m -63.29 -34.49 77.8 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.285 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 20.0 tp -61.83 -43.19 99.34 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.109 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 81.3 t -65.45 -10.93 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.124 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -76.82 -21.65 54.76 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.633 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.46 -38.97 16.78 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 121.367 -0.133 . . . . 0.0 111.019 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.508 HG22 ' O ' ' B' ' 708' ' ' VAL . 11.4 p -88.15 25.55 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.301 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 46.7 ttt85 -60.07 138.78 57.8 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.503 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.705 -179.866 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 N--CA 1.493 1.721 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.472 HD11 ' CZ2' ' C' ' 666' ' ' TRP . 0.1 OUTLIER -48.88 134.92 16.18 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.951 -179.442 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -168.55 151.84 5.49 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.081 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.696 HD22 ' N ' ' C' ' 664' ' ' ASP . 0.0 OUTLIER -56.67 -29.18 62.06 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.264 -179.166 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 664' ' ' ASP . . . . . 0.696 ' N ' HD22 ' C' ' 663' ' ' LEU . 4.8 t70 -74.17 -27.19 60.71 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.677 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.89 -39.25 76.37 Favored 'General case' 0 C--O 1.219 -0.535 0 O-C-N 123.355 0.409 . . . . 0.0 110.812 -179.282 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 666' ' ' TRP . . . . . 0.472 ' CZ2' HD11 ' C' ' 661' ' ' LEU . 79.8 m95 -63.69 -52.16 61.84 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.4 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -51.89 -34.34 40.84 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 37.4 m -59.12 -34.41 72.01 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.944 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 10.8 mp -78.07 -9.71 59.27 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 11.7 m0 -68.66 -26.24 65.21 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.115 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -62.78 -42.61 99.78 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -79.58 -22.17 44.09 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -177.653 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 69.08 -44.2 0.53 Allowed 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.895 1.225 . . . . 0.0 113.063 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -57.56 -52.8 63.93 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 118.431 0.56 . . . . 0.0 111.585 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.61 -30.34 46.95 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.531 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.2 m -58.73 -45.24 90.08 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.577 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -78.42 -22.37 47.85 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.932 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -56.37 -22.12 29.15 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.143 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.27 -33.15 13.35 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.903 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 680' ' ' TRP . . . . . 0.46 ' O ' HD12 ' C' ' 684' ' ' ILE . 0.0 OUTLIER -97.89 24.37 7.0 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.632 -179.266 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -133.03 -39.4 0.95 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.559 HD13 ' C ' ' C' ' 682' ' ' ILE . 0.0 OUTLIER -61.15 -45.62 98.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.51 0 CA-C-N 116.325 -0.398 . . . . 0.0 109.99 178.498 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 30.8 ttp180 -59.29 -46.71 87.82 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 121.237 0.541 . . . . 0.0 110.257 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.46 HD12 ' O ' ' C' ' 680' ' ' TRP . 80.0 mt -67.88 -36.47 75.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.468 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.41 -28.98 14.33 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -175.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.82 HG12 HG23 ' A' ' 686' ' ' ILE . 2.2 mp -60.03 -39.98 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 119.474 -0.891 . . . . 0.0 109.059 178.35 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 46.5 mt -58.72 -41.51 82.61 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 34.3 mm -59.8 -44.15 93.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.526 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 53.6 t -68.18 -24.15 29.62 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.118 0 CA-C-O 118.924 -0.56 . . . . 0.0 112.149 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.6 -61.23 7.72 Favored Glycine 0 C--N 1.354 1.535 0 N-CA-C 110.149 -1.181 . . . . 0.0 110.149 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 45.4 m -57.33 -31.52 65.78 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.585 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -60.8 -47.17 87.54 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.676 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.693 HD13 ' O ' ' C' ' 693' ' ' ILE . 0.2 OUTLIER -73.09 -34.34 44.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 119.986 -0.685 . . . . 0.0 109.959 179.562 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.82 -43.4 96.59 Favored Glycine 0 CA--C 1.54 1.628 0 C-N-CA 120.665 -0.778 . . . . 0.0 111.335 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.779 ' O ' HD22 ' C' ' 695' ' ' LEU . 0.1 OUTLIER -56.22 -31.29 63.36 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 117.004 0.402 . . . . 0.0 110.572 -179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.406 ' N ' HD13 ' C' ' 695' ' ' LEU . 21.6 mmm180 -49.81 -34.69 20.32 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.727 ' O ' HD13 ' C' ' 697' ' ' ILE . 0.2 OUTLIER -57.89 -40.12 74.73 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -175.225 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.465 HG12 ' O ' ' C' ' 695' ' ' LEU . 8.7 p -54.9 -28.43 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.148 -177.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -60.32 -35.68 76.19 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.05 -39.08 71.48 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.817 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 86.2 t -62.49 -31.86 53.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.115 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 12.7 tp -58.69 -37.03 75.19 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.452 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 10.3 p -57.83 -35.56 71.05 Favored 'General case' 0 C--O 1.219 -0.521 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.844 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.6 tp -58.86 -37.04 75.63 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.811 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 16.3 t -76.28 -16.23 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.201 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -63.12 -28.87 70.36 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 707' ' ' ARG . . . . . 0.536 ' HG3' HG13 ' C' ' 708' ' ' VAL . 48.2 ptt85 -86.42 -37.36 18.42 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.314 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 708' ' ' VAL . . . . . 0.536 HG13 ' HG3' ' C' ' 707' ' ' ARG . 33.6 m -90.95 -1.76 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.276 0.472 . . . . 0.0 112.276 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 12.9 mmp_? . . . . . 0 N--CA 1.471 0.606 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.718 179.561 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 660' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.475 HD12 ' CD1' ' C' ' 666' ' ' TRP . 34.0 mt -74.78 177.92 5.85 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -169.75 168.94 8.73 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.417 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.434 HD11 ' N ' ' B' ' 660' ' ' LEU . 8.9 tt -61.59 -40.14 93.72 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.671 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.19 -24.43 62.23 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.738 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -66.54 -46.03 77.48 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.244 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -73.19 -51.96 15.89 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.21 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 667' ' ' ALA . . . . . 0.478 ' HB2' HD22 ' B' ' 660' ' ' LEU . . . -58.38 -22.63 54.49 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.772 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 13.6 t -60.41 -32.58 71.48 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.298 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 669' ' ' LEU . 3.3 mm? -71.4 -14.22 62.1 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.41 -0.516 . . . . 0.0 112.061 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -68.97 -12.69 61.9 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.95 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -62.65 -48.23 80.22 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.231 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.71 -22.61 15.32 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.094 179.409 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 9.7 t80 59.02 -0.34 0.14 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -63.53 -53.03 58.26 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 118.894 0.77 . . . . 0.0 110.867 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.52 HD13 ' O ' ' A' ' 675' ' ' ILE . 0.3 OUTLIER -69.05 -31.61 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.826 179.159 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.3 m -58.69 -44.95 90.44 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.76 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -60.64 -41.55 95.16 Favored 'General case' 0 C--O 1.215 -0.721 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.589 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 11.1 t90 -71.17 -27.66 63.69 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.375 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.5 -15.15 31.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -111.13 -5.26 14.78 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -118.42 -11.11 10.03 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.569 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 15.3 tt -66.83 -38.91 82.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.748 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -56.48 -48.33 77.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 120.056 -0.657 . . . . 0.0 109.436 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 82.0 mt -63.7 -46.88 93.45 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -29.09 24.43 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.427 HG23 HG12 ' B' ' 686' ' ' ILE . 1.0 OUTLIER -58.36 -43.34 86.16 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.191 -179.082 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 46.7 mt -58.68 -41.45 82.35 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.259 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 42.5 mm -56.28 -41.31 70.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 689' ' ' VAL . 46.3 t -68.09 -0.27 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 120.531 -0.467 . . . . 0.0 111.411 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -99.24 -31.94 5.99 Favored Glycine 0 CA--C 1.535 1.329 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.1 m -73.72 -16.86 61.18 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.853 0.327 . . . . 0.0 111.232 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.0 -40.14 80.02 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.224 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.703 HD13 ' O ' ' A' ' 693' ' ' ILE . 0.2 OUTLIER -70.61 -35.42 61.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.368 179.668 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.67 -47.78 83.51 Favored Glycine 0 C--N 1.347 1.159 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.632 HD23 ' O ' ' A' ' 695' ' ' LEU . 4.6 tt -56.13 -31.68 63.55 Favored 'General case' 0 C--O 1.21 -1.013 0 CA-C-O 121.032 0.444 . . . . 0.0 110.793 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -50.52 -34.82 26.77 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.5 tp -58.04 -40.07 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -175.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.576 HG22 ' O ' ' A' ' 695' ' ' LEU . 17.4 m -55.27 -28.04 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 118.807 0.73 . . . . 0.0 110.696 -178.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -55.76 -36.38 67.26 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.43 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.66 -50.51 73.58 Favored 'General case' 0 C--O 1.219 -0.536 0 O-C-N 123.291 0.369 . . . . 0.0 111.064 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 698' ' ' VAL . 9.0 p -68.16 -33.99 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 120.491 -0.484 . . . . 0.0 109.939 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 702' ' ' LEU . . . . . 0.79 ' O ' HG12 ' A' ' 705' ' ' VAL . 0.3 OUTLIER -66.58 -36.99 83.99 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 178.814 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 703' ' ' SER . . . . . 0.448 ' N ' HD23 ' A' ' 702' ' ' LEU . 66.8 m -64.4 -43.93 92.9 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.394 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 11.4 tp -81.01 -17.46 50.23 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.79 HG12 ' O ' ' A' ' 702' ' ' LEU . 2.5 p -60.89 -29.24 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.226 -178.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -61.91 -11.12 11.48 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 52.5 ttt85 -73.68 -35.3 65.18 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 121.112 -0.235 . . . . 0.0 110.795 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 47.3 t -102.44 -36.19 4.33 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.531 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.18 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -162.39 154.7 19.14 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.899 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.105 -0.95 . . . . 0.0 110.83 179.972 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 667' ' ' ALA . 12.5 tp . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 55.0 mt -135.93 149.49 48.95 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.358 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -178.6 174.47 1.2 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.61 HD12 ' N ' ' B' ' 664' ' ' ASP . 0.3 OUTLIER -58.3 -15.07 8.86 Favored 'General case' 0 C--O 1.211 -0.967 0 C-N-CA 119.041 -1.063 . . . . 0.0 111.06 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 664' ' ' ASP . . . . . 0.61 ' N ' HD12 ' B' ' 663' ' ' LEU . 4.0 p-10 -66.25 -39.72 89.68 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -70.67 -46.42 63.22 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.743 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 666' ' ' TRP . . . . . 0.515 ' CD1' HD12 ' C' ' 661' ' ' LEU . 77.0 m95 -73.19 -30.64 63.69 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -81.52 -10.74 59.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.542 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 5.7 t -75.23 -32.58 61.17 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 121.147 -0.221 . . . . 0.0 110.86 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' B' ' 666' ' ' TRP . 0.0 OUTLIER -65.29 -12.61 53.44 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.686 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 14.1 m95 -68.22 -19.41 64.74 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.112 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -89.46 -47.95 7.65 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 672' ' ' TRP . . . . . 0.429 ' CH2' HD22 ' B' ' 669' ' ' LEU . 6.1 p-90 -103.16 -23.51 13.64 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 -177.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 51.15 -3.45 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 116.228 1.936 . . . . 0.0 116.228 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -53.27 55.69 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 120.217 1.371 . . . . 0.0 113.68 -177.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.32 -27.93 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 119.639 -0.825 . . . . 0.0 110.755 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.3 m -59.11 -50.06 75.49 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.105 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -69.03 -20.95 64.14 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.542 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 8.2 t90 -72.19 -46.86 54.55 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.43 -10.45 32.42 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -92.55 -15.44 26.97 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 119.886 -0.725 . . . . 0.0 112.226 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -114.04 -31.53 6.33 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.43 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 23.8 mm -65.59 -44.66 93.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-O 119.24 -0.41 . . . . 0.0 111.48 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -42.7 76.63 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.172 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 84.4 mt -68.7 -41.96 82.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.409 ' HA ' HD13 ' B' ' 688' ' ' ILE . 10.9 t80 -52.79 -28.86 24.38 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.024 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.686 HG21 HD12 ' C' ' 686' ' ' ILE . 1.4 mp -58.73 -37.61 67.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.5 mt -58.54 -41.87 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 688' ' ' ILE . . . . . 0.513 ' N ' HD12 ' B' ' 688' ' ' ILE . 2.7 mp -62.34 -41.28 91.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.451 ' O ' HG12 ' B' ' 689' ' ' VAL . 47.2 t -67.86 -4.14 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.305 -179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.46 -45.11 7.06 Favored Glycine 0 C--N 1.348 1.24 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 2.5 m -69.76 -22.9 63.31 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.856 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -54.34 -32.94 57.9 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.964 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 1.9 pp -65.2 -38.21 82.08 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.808 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 694' ' ' GLY . . . . . 0.687 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -64.58 -51.73 49.43 Favored Glycine 0 C--O 1.213 -1.172 0 N-CA-C 111.15 -0.78 . . . . 0.0 111.15 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.428 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.4 OUTLIER -56.72 -42.25 78.87 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.366 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -30.27 13.99 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.687 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.6 tp -58.63 -40.54 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -175.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.428 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -55.88 -28.03 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 118.306 0.503 . . . . 0.0 111.773 -178.743 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -55.29 -26.98 43.71 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.275 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.77 -35.61 63.97 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.145 178.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 64.8 t -59.86 -32.73 50.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.926 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 1.1 pp -61.44 -30.79 70.8 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.296 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.6 t -58.1 -36.19 72.51 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.988 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 704' ' ' LEU . . . . . 0.492 ' O ' HG12 ' B' ' 708' ' ' VAL . 18.0 tp -63.93 -32.39 73.9 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.235 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 21.4 t -83.08 -33.71 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 120.969 -0.293 . . . . 0.0 110.375 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -65.28 -34.32 78.07 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.579 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.57 -33.54 62.7 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.56 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.51 HG22 ' O ' ' B' ' 708' ' ' VAL . 9.9 p -111.11 26.11 3.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.292 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -49.35 111.21 0.46 Allowed 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.95 -0.3 . . . . 0.0 111.226 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.976 -179.888 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.515 HD12 ' CD1' ' B' ' 666' ' ' TRP . 3.4 mt -73.45 -172.01 1.1 Allowed 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -144.89 106.93 4.3 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.07 -33.12 68.71 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.359 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -60.55 -23.9 64.98 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.658 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 665' ' ' LYS . . . . . 0.446 ' CE ' HG21 ' C' ' 675' ' ' ILE . 7.7 tmtt? -70.13 -41.68 73.6 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.15 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 666' ' ' TRP . . . . . 0.79 ' O ' HD12 ' C' ' 669' ' ' LEU . 76.2 m95 -73.05 -33.89 65.95 Favored 'General case' 0 C--O 1.214 -0.803 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.041 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -83.2 -30.75 27.51 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.013 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 3.3 p -56.23 -30.92 63.0 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.6 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 669' ' ' LEU . . . . . 0.79 HD12 ' O ' ' C' ' 666' ' ' TRP . 0.0 OUTLIER -55.37 -10.97 0.69 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -177.78 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 670' ' ' TRP . . . . . 0.762 ' N ' HD13 ' C' ' 669' ' ' LEU . 20.6 m95 -68.19 -31.1 70.39 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.451 -0.9 . . . . 0.0 109.915 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -83.29 -50.0 8.83 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 119.642 -0.823 . . . . 0.0 112.791 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 672' ' ' TRP . . . . . 0.533 ' CZ3' HG22 ' C' ' 675' ' ' ILE . 4.8 p-90 -97.94 -23.53 15.78 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 116.296 1.961 . . . . 0.0 116.296 -178.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 54.89 -7.38 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 121.453 1.933 . . . . 0.0 115.758 177.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -63.47 -53.06 58.04 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.533 HG22 ' CZ3' ' C' ' 672' ' ' TRP . 0.4 OUTLIER -69.08 -40.03 80.23 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 C-N-CA 118.88 -1.128 . . . . 0.0 112.617 -178.199 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 676' ' ' THR . . . . . 0.524 ' HB ' HD23 ' C' ' 669' ' ' LEU . 77.2 m -63.61 -33.78 76.37 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.926 -179.015 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -64.79 -47.09 79.36 Favored 'General case' 0 C--O 1.21 -0.995 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.113 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.487 ' O ' HG23 ' C' ' 682' ' ' ILE . 2.5 t90 -72.31 -45.99 57.61 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.154 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.554 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -71.57 -32.86 68.54 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.735 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -110.37 62.29 0.6 Allowed 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -173.92 -33.99 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.231 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.487 HG23 ' O ' ' C' ' 678' ' ' TRP . 16.3 pt -55.19 -36.89 41.39 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.723 0 CA-C-O 119.324 -0.369 . . . . 0.0 111.88 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 10.9 mtp180 -56.69 -48.32 77.93 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.434 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 81.1 mt -67.56 -44.48 86.39 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.562 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.291 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.484 ' HA ' HD12 ' C' ' 688' ' ' ILE . 4.7 m-85 -53.06 -28.45 24.81 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.907 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.686 HD12 HG21 ' B' ' 686' ' ' ILE . 14.8 mm -58.29 -40.11 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 120.023 -0.671 . . . . 0.0 110.098 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.5 mt -59.78 -42.11 87.76 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.601 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.484 HD12 ' HA ' ' C' ' 685' ' ' PHE . 66.6 mt -65.1 -41.44 91.86 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.129 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.617 ' O ' HD12 ' C' ' 692' ' ' LEU . 96.2 t -67.48 -22.34 28.61 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.171 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.872 -176.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.01 -4.13 90.36 Favored Glycine 0 CA--C 1.55 2.251 0 CA-C-N 119.668 1.122 . . . . 0.0 113.665 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 43.3 m -88.82 -34.7 16.95 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.76 1.28 . . . . 0.0 113.223 -178.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 692' ' ' LEU . . . . . 0.898 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -64.79 -31.75 73.12 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.073 -178.775 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.898 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.0 OUTLIER -69.03 -29.17 42.23 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 179.268 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.69 -40.85 95.38 Favored Glycine 0 CA--C 1.541 1.707 0 C-N-CA 120.193 -1.003 . . . . 0.0 110.97 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.507 HD23 ' O ' ' C' ' 695' ' ' LEU . 1.3 tt -56.8 -34.08 67.31 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.27 -34.83 24.65 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.699 ' O ' HD13 ' C' ' 697' ' ' ILE . 0.2 OUTLIER -58.27 -40.69 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -175.469 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.404 HG12 ' O ' ' C' ' 695' ' ' LEU . 8.2 p -56.02 -28.93 25.74 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.924 0 CA-C-N 119.187 0.903 . . . . 0.0 111.064 -178.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 699' ' ' PHE . . . . . 0.439 ' O ' HD23 ' C' ' 702' ' ' LEU . 0.1 OUTLIER -57.6 -35.45 70.45 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.759 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.7 -35.62 66.26 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -177.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.84 -31.47 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.799 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 702' ' ' LEU . . . . . 0.439 HD23 ' O ' ' C' ' 699' ' ' PHE . 1.4 pp -58.54 -25.52 62.56 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.943 -179.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 74.2 m -57.85 -38.35 75.52 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.332 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 704' ' ' LEU . . . . . 0.574 HD13 ' O ' ' C' ' 704' ' ' LEU . 0.5 OUTLIER -60.15 -39.14 85.31 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.355 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.8 t -69.91 -18.82 22.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.868 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -60.67 -16.65 41.36 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 707' ' ' ARG . . . . . 0.539 ' HG3' HG23 ' C' ' 708' ' ' VAL . 13.7 ptm180 -73.87 -37.57 64.7 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.703 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 708' ' ' VAL . . . . . 0.539 HG23 ' HG3' ' C' ' 707' ' ' ARG . 21.0 t -96.46 9.5 6.17 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.801 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 15.2 tpp85 . . . . . 0 N--CA 1.473 0.691 0 O-C-N 122.267 -0.271 . . . . 0.0 110.874 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.654 ' CG ' HD23 ' C' ' 663' ' ' LEU . 10.1 tt . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.623 HD23 ' CE2' ' A' ' 666' ' ' TRP . 1.5 tp -150.72 -54.72 0.15 Allowed 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.393 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 48.42 177.39 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.529 HD12 ' HB2' ' B' ' 660' ' ' LEU . 8.1 tt -52.33 -38.59 58.99 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 114.254 -1.339 . . . . 0.0 111.588 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -60.97 -41.81 97.09 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -177.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 665' ' ' LYS . . . . . 0.417 ' HG3' ' HA ' ' A' ' 661' ' ' LEU . 23.7 mmtp -71.11 -44.51 65.5 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 118.869 -1.133 . . . . 0.0 112.497 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 666' ' ' TRP . . . . . 0.623 ' CE2' HD23 ' A' ' 661' ' ' LEU . 85.5 m95 -59.04 -39.2 81.26 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.955 -179.006 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.23 -39.65 94.4 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.238 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 32.2 t -58.11 -32.68 68.34 Favored 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.557 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.505 HD22 ' OG1' ' A' ' 676' ' ' THR . 0.4 OUTLIER -69.7 -7.76 42.06 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.43 179.812 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 33.8 m0 -75.28 -6.75 51.44 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -62.57 -48.96 77.17 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.283 -179.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.72 -22.53 13.54 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 19.1 p90 49.67 -3.07 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -63.71 -53.55 49.38 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-N 120.355 1.434 . . . . 0.0 110.165 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 14.6 mm -69.43 -27.84 35.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.469 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 676' ' ' THR . . . . . 0.505 ' OG1' HD22 ' A' ' 669' ' ' LEU . 32.9 m -58.92 -48.63 80.79 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -64.92 -34.84 79.37 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.456 ' O ' HG23 ' A' ' 682' ' ' ILE . 28.5 t90 -64.38 -19.91 65.79 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.765 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -84.96 -2.68 58.2 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 120.297 -0.561 . . . . 0.0 112.195 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 53.9 t-105 -145.16 -43.93 0.23 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 120.123 -0.631 . . . . 0.0 112.108 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -66.22 -13.08 59.76 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.456 HG23 ' O ' ' A' ' 678' ' ' TRP . 13.7 pt -55.33 -36.15 39.39 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.721 0 C-N-CA 120.536 -0.465 . . . . 0.0 110.935 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.54 ' NH2' HD22 ' B' ' 679' ' ' LEU . 26.0 ttp180 -54.86 -32.77 61.08 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.894 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 45.2 mm -59.69 -48.28 88.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.066 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -67.82 -28.2 67.37 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.543 HD12 HG21 ' C' ' 686' ' ' ILE . 29.2 mm -58.12 -43.16 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.451 0.569 . . . . 0.0 111.853 -177.087 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 63.4 mt -58.29 -41.88 82.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.024 -179.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 47.5 mt -62.83 -41.49 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.619 ' O ' HD11 ' A' ' 692' ' ' LEU . 60.5 t -68.21 -3.96 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -177.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -101.5 6.21 55.26 Favored Glycine 0 CA--C 1.543 1.794 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.846 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 14.6 m -88.31 -34.23 17.73 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 117.4 0.6 . . . . 0.0 111.781 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.619 HD11 ' O ' ' A' ' 689' ' ' VAL . 0.2 OUTLIER -54.0 -32.64 54.76 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.488 -178.496 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.718 HD13 ' O ' ' A' ' 693' ' ' ILE . 0.2 OUTLIER -61.75 -37.9 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.529 -179.013 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.82 -36.82 74.91 Favored Glycine 0 C--O 1.212 -1.219 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.76 -36.44 69.79 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.53 ' HG3' HD11 ' C' ' 693' ' ' ILE . 86.6 mmt-85 -52.76 -35.94 57.15 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -178.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 697' ' ' ILE . . . . . 0.433 HD12 ' N ' ' A' ' 698' ' ' VAL . 2.3 pp -59.15 -41.82 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.688 ' O ' HG12 ' A' ' 701' ' ' VAL . 9.2 p -64.88 -29.57 47.79 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.815 0 C-N-CA 118.889 -1.124 . . . . 0.0 111.272 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -55.8 -35.57 66.46 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 121.129 -0.228 . . . . 0.0 110.897 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.91 -35.6 66.77 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.978 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.688 HG12 ' O ' ' A' ' 698' ' ' VAL . 1.7 p -59.91 -33.11 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.914 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.6 tt -65.86 -29.84 70.35 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.182 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 42.3 p -57.59 -47.42 82.15 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.698 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.52 -39.39 94.31 Favored 'General case' 0 C--O 1.215 -0.719 0 CA-C-N 116.34 -0.391 . . . . 0.0 109.95 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 73.8 t -60.85 -15.38 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -80.23 -12.63 59.61 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -73.82 -27.79 61.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 120.091 -0.644 . . . . 0.0 111.579 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 39.1 t -82.81 -36.08 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.438 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.94 179.14 5.05 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.396 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.848 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.529 ' HB2' HD12 ' A' ' 663' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.427 HD12 ' CZ2' ' B' ' 666' ' ' TRP . 4.5 mm? -108.3 119.18 38.75 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.936 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -137.98 162.08 35.02 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.381 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.452 HD23 ' C ' ' B' ' 663' ' ' LEU . 10.6 tt -59.18 -40.17 84.84 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.932 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -73.79 -25.32 60.07 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.913 -179.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -68.82 -46.15 69.36 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.783 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 666' ' ' TRP . . . . . 0.427 ' CZ2' HD12 ' B' ' 661' ' ' LEU . 95.6 m95 -64.52 -53.58 45.79 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 120.834 -0.347 . . . . 0.0 110.856 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 667' ' ' ALA . . . . . 0.5 ' HB2' HD13 ' C' ' 660' ' ' LEU . . . -58.48 -23.13 56.99 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.116 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.92 -33.29 70.39 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.877 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 68.9 mt -65.03 -17.52 64.52 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -68.51 -2.9 9.79 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 120.612 -0.435 . . . . 0.0 112.002 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -73.32 -48.61 32.98 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.231 -0.588 . . . . 0.0 112.2 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.88 -23.17 13.4 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.82 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 42.8 t80 58.92 -12.25 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -63.55 -52.56 60.58 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 119.345 0.975 . . . . 0.0 111.636 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.496 HD11 HD23 ' B' ' 679' ' ' LEU . 6.6 tp -68.46 -27.77 37.84 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.971 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.613 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 25.8 m -58.41 -41.77 85.71 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.405 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -62.75 -45.56 92.15 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.827 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -72.14 -37.3 69.47 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.064 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 679' ' ' LEU . . . . . 0.54 HD22 ' NH2' ' A' ' 683' ' ' ARG . 0.2 OUTLIER -78.66 -3.09 42.31 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -178.149 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -120.37 -35.2 3.47 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 120.138 -0.625 . . . . 0.0 112.115 -178.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -66.52 -7.69 21.65 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.295 -0.562 . . . . 0.0 112.156 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.546 ' O ' HD13 ' B' ' 686' ' ' ILE . 0.2 OUTLIER -67.8 -46.27 82.72 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 119.926 -0.71 . . . . 0.0 112.535 -179.326 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 37.3 ptt180 -62.96 -42.8 99.93 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 118.58 0.627 . . . . 0.0 111.654 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 94.7 mt -65.7 -43.98 93.5 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -57.27 -34.18 68.39 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.22 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.905 HG21 HD11 ' C' ' 686' ' ' ILE . 1.1 mp -58.72 -46.14 90.73 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 62.7 mt -58.65 -41.6 82.66 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.548 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 15.6 mm -59.64 -42.92 89.99 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.547 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 75.3 t -68.38 -15.74 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 CA-C-O 119.277 -0.392 . . . . 0.0 111.885 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -71.27 -54.18 9.36 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 44.1 m -64.44 -23.22 67.21 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.291 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.99 -32.77 55.09 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.565 -178.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 2.4 pp -65.3 -39.37 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.097 -178.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.18 -48.06 78.71 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.098 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.406 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.1 mt -56.83 -42.25 79.29 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 117.153 0.477 . . . . 0.0 111.9 -178.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.48 -29.92 11.57 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.743 HD11 ' HD3' ' C' ' 696' ' ' ARG . 41.7 mm -58.44 -40.57 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 CA-C-O 119.023 -0.513 . . . . 0.0 111.679 -176.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.406 HG12 ' O ' ' B' ' 695' ' ' LEU . 5.4 p -55.76 -28.16 23.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 118.652 0.66 . . . . 0.0 111.296 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -55.35 -26.84 43.37 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.346 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.66 54.23 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.006 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.99 -34.92 58.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.219 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.33 -35.23 73.44 Favored 'General case' 0 C--O 1.219 -0.522 0 O-C-N 123.007 0.192 . . . . 0.0 110.608 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.6 t -57.98 -31.85 67.31 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.855 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 6.9 tp -60.65 -42.5 97.11 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 61.1 t -73.69 -19.82 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -64.44 -8.63 14.2 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 28.2 mtt180 -73.96 -40.95 62.66 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.175 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 34.9 t -87.52 -36.19 9.34 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.784 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 -122.26 145.32 48.34 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.138 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 . . . . . 0 C--O 1.221 -0.424 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.683 -179.925 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' B' ' 667' ' ' ALA . 58.1 mt . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 2.1 tp -45.77 142.07 2.67 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 111.45 0.167 . . . . 0.0 111.45 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 662' ' ' GLU . . . . . 0.434 ' HG3' HD12 ' B' ' 663' ' ' LEU . 2.0 mt-10 -169.7 165.69 9.97 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.197 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.691 HD13 ' H ' ' C' ' 664' ' ' ASP . 0.0 OUTLIER -58.09 -31.12 66.8 Favored 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.509 -179.416 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 664' ' ' ASP . . . . . 0.691 ' H ' HD13 ' C' ' 663' ' ' LEU . 6.2 t70 -74.22 -27.43 60.79 Favored 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -63.28 -42.31 99.08 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.321 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -58.74 -31.41 68.29 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.55 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.89 -16.17 6.25 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.513 178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 17.6 m -53.23 -32.96 50.86 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.45 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 669' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' C' ' 673' ' ' PHE . 11.9 tp -55.83 -13.44 1.78 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.841 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -69.59 -43.44 72.79 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -177.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -88.78 -52.01 5.35 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 117.25 -1.78 . . . . 0.0 113.67 -177.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 672' ' ' TRP . . . . . 0.425 ' CE3' ' HB2' ' C' ' 674' ' ' ASP 0.258 6.0 p-90 -103.96 -21.96 13.55 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 178.142 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 673' ' ' PHE . . . . . 0.437 ' HA ' HD12 ' C' ' 669' ' ' LEU . 2.2 t80 72.53 -27.77 0.19 Allowed 'General case' 0 C--N 1.373 1.622 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 674' ' ' ASP . . . . . 0.425 ' HB2' ' CE3' ' C' ' 672' ' ' TRP . 0.1 OUTLIER -64.26 -53.08 54.65 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -175.419 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 10.9 tp -69.76 -48.8 62.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 CA-C-N 120.946 1.703 . . . . 0.0 115.25 -176.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 676' ' ' THR . . . . . 0.404 ' HB ' ' CD1' ' C' ' 669' ' ' LEU . 19.8 m -61.27 -33.88 74.26 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 118.973 -1.091 . . . . 0.0 109.123 -178.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -62.84 -17.5 61.46 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.082 177.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.406 ' O ' HD13 ' C' ' 682' ' ' ILE . 19.6 t90 -71.89 -44.66 63.37 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.501 ' N ' HD12 ' C' ' 679' ' ' LEU . 7.5 mp -67.93 -2.77 8.07 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.596 -178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.35 168.85 18.16 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 78.49 -39.05 0.25 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.541 0.736 . . . . 0.0 110.711 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.406 HD13 ' O ' ' C' ' 678' ' ' TRP . 1.7 mp -58.77 -36.8 62.54 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -55.83 -44.47 77.96 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.061 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 44.3 mt -68.33 -36.81 76.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.347 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -52.01 -30.21 24.3 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.905 HD11 HG21 ' B' ' 686' ' ' ILE . 1.8 mp -64.07 -42.98 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 65.6 mt -58.84 -41.22 82.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 46.5 mm -56.8 -41.86 76.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.495 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 57.4 t -67.81 -31.51 52.55 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 119.904 -0.719 . . . . 0.0 111.358 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 690' ' ' GLY . . . . . 0.448 ' O ' HG22 ' C' ' 693' ' ' ILE . . . -55.09 -47.68 72.18 Favored Glycine 0 C--N 1.353 1.506 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.6 -33.98 76.88 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.169 178.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.2 tp -62.04 -57.06 13.05 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.612 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.771 HD13 ' O ' ' C' ' 693' ' ' ILE . 0.1 OUTLIER -55.96 -29.07 25.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.128 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.24 -41.09 94.7 Favored Glycine 0 CA--C 1.541 1.695 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.667 ' O ' HG22 ' C' ' 698' ' ' VAL . 0.9 OUTLIER -56.54 -31.22 63.95 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 117.369 0.584 . . . . 0.0 111.223 179.396 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.743 ' HD3' HD11 ' B' ' 697' ' ' ILE . 1.5 mmt180 -49.78 -35.24 21.86 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 6.9 tp -58.68 -40.92 80.84 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -175.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.667 HG22 ' O ' ' C' ' 695' ' ' LEU . 16.4 m -55.91 -28.5 24.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 CA-C-N 119.305 0.957 . . . . 0.0 111.31 -178.592 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -55.63 -35.5 65.98 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.299 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.81 -39.02 70.76 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.015 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 75.2 t -68.05 -39.79 82.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.92 -28.8 66.57 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.512 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 23.4 p -59.92 -35.52 75.06 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.652 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.2 tp -59.11 -40.62 85.91 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 20.1 t -66.29 -19.8 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.594 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -60.76 -10.91 6.12 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 23.0 ptt85 -101.02 -12.76 18.62 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 55.9 t -82.86 -30.86 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.226 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 83.4 mtm-85 . . . . . 0 C--O 1.218 -0.572 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.27 -179.083 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.46 HD22 ' CD1' ' C' ' 666' ' ' TRP . 5.4 tp -67.11 -146.74 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -169.34 96.34 0.33 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.367 0.53 . . . . 0.0 110.919 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.515 ' C ' HD23 ' A' ' 663' ' ' LEU . 9.9 tt -67.08 -40.43 87.01 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-O 120.929 0.395 . . . . 0.0 111.368 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -68.21 -23.5 64.83 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.248 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -67.26 -34.6 77.77 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.709 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -61.08 -35.74 77.79 Favored 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.512 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 667' ' ' ALA . . . . . 0.401 ' HB2' HD22 ' B' ' 660' ' ' LEU . . . -92.37 -19.26 22.28 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.97 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 75.5 m -73.91 -37.34 64.68 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.044 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.531 HD12 ' C ' ' A' ' 669' ' ' LEU . 4.4 pp -63.48 -9.06 11.05 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.889 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -68.34 -19.73 64.67 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.219 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -84.67 -48.13 9.78 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 4.5 p90 -100.95 -22.74 14.7 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 118.082 0.401 . . . . 0.0 111.967 -178.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 48.58 16.64 0.11 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -63.4 -54.03 43.13 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.18 -177.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.626 HD12 HD12 ' A' ' 679' ' ' LEU . 0.3 OUTLIER -69.77 -31.32 47.96 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 C-N-CA 119.699 -0.8 . . . . 0.0 110.704 178.291 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 13.8 m -58.26 -33.84 69.84 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.459 -178.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -59.69 -44.05 93.8 Favored 'General case' 0 C--O 1.215 -0.753 0 C-N-CA 119.817 -0.753 . . . . 0.0 108.973 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -72.82 -46.09 54.94 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.451 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.626 HD12 HD12 ' A' ' 675' ' ' ILE . 14.1 mt -67.57 -2.87 7.34 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -177.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.7 m95 -133.23 142.51 48.6 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 92.12 -32.51 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.232 1.013 . . . . 0.0 111.277 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.613 HD12 ' N ' ' A' ' 683' ' ' ARG . 2.7 pp -68.09 -41.23 84.13 Favored 'Isoleucine or valine' 0 C--N 1.35 0.624 0 C-N-CA 119.315 -0.954 . . . . 0.0 109.55 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.613 ' N ' HD12 ' A' ' 682' ' ' ILE . 54.3 ttp180 -69.28 -47.08 65.62 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.98 -37.43 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.734 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -52.19 -43.72 64.34 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.865 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.484 HG12 HG22 ' C' ' 686' ' ' ILE . 1.9 mp -58.73 -37.91 68.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.753 179.355 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 39.6 mm -58.04 -42.13 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 80.2 mt -59.86 -41.19 84.94 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 176.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.664 HG13 HG21 ' C' ' 693' ' ' ILE . 57.2 t -67.51 -25.41 33.15 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.593 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.76 -32.28 81.12 Favored Glycine 0 C--N 1.35 1.336 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.9 m -86.16 -31.82 21.59 Favored 'General case' 0 C--O 1.219 -0.529 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.418 HD23 HD12 ' C' ' 693' ' ' ILE . 5.2 tp -59.69 -44.63 93.58 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.009 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.555 HD11 ' CG ' ' B' ' 696' ' ' ARG . 4.1 tp -55.58 -35.85 39.88 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.988 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -72.61 -40.11 54.44 Favored Glycine 0 C--O 1.215 -1.078 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.799 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.8 OUTLIER -56.8 -40.21 75.51 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 120.861 0.362 . . . . 0.0 110.886 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.747 ' HG3' HD11 ' C' ' 693' ' ' ILE . 40.4 mmt180 -53.31 -35.21 59.91 Favored 'General case' 0 C--O 1.214 -0.789 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 697' ' ' ILE . . . . . 0.672 HD13 ' O ' ' A' ' 697' ' ' ILE . 0.2 OUTLIER -58.27 -40.69 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 120.451 -0.499 . . . . 0.0 112.008 -176.019 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.799 HG12 ' O ' ' A' ' 695' ' ' LEU . 12.4 p -55.96 -28.26 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.021 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -55.41 -35.88 65.85 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.602 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.02 -35.71 67.15 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.435 -0.506 . . . . 0.0 109.763 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 92.6 t -65.77 -34.36 69.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 9.0 tp -60.28 -29.84 69.08 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.915 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 26.8 m -57.95 -45.52 86.51 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.657 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 15.0 tp -64.88 -39.99 94.42 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 78.0 t -69.73 -24.94 27.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.56 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -71.0 -31.38 67.89 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.402 ' HG3' HG13 ' A' ' 708' ' ' VAL . 0.1 OUTLIER -74.38 -23.11 58.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.843 -179.172 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.402 HG13 ' HG3' ' A' ' 707' ' ' ARG . 33.9 m -99.36 25.97 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 C-N-CA 120.534 -0.467 . . . . 0.0 111.259 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -51.09 70.85 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.357 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.83 179.741 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.401 HD22 ' HB2' ' A' ' 667' ' ' ALA . 9.8 tp . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 60.3 mt 61.13 123.61 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.344 0.403 . . . . 0.0 111.091 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -158.32 176.94 11.82 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.99 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.74 -39.52 88.99 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.486 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.09 -28.23 64.18 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.693 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -69.95 -46.02 66.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.741 -179.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -70.14 -37.58 75.29 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.591 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.32 -41.96 80.07 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.0 p -54.48 -31.5 55.93 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.475 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.851 HD21 HG23 ' B' ' 675' ' ' ILE . 13.0 tp -61.84 -10.5 9.33 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.918 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 670' ' ' TRP . . . . . 0.416 ' HZ2' HD13 ' C' ' 660' ' ' LEU . 37.8 m0 -68.4 -25.51 65.08 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.885 -0.726 . . . . 0.0 111.112 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -62.98 -46.29 88.41 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -23.91 13.6 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 120.009 -0.676 . . . . 0.0 111.447 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 72.7 t80 45.56 10.47 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -64.13 -54.7 29.66 Favored 'General case' 0 C--N 1.354 0.782 0 CA-C-N 119.74 1.155 . . . . 0.0 113.356 -177.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.851 HG23 HD21 ' B' ' 669' ' ' LEU . 9.2 tp -69.98 -27.58 33.27 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.914 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.838 178.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 9.4 m -58.71 -45.9 88.52 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.898 -178.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -61.81 -47.19 86.24 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.264 -0.575 . . . . 0.0 111.557 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.403 ' CE3' HD12 ' B' ' 675' ' ' ILE . 3.6 t90 -72.21 -42.04 66.21 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 7.9 tp -74.25 -33.01 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -177.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -96.28 23.95 6.19 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.204 -0.599 . . . . 0.0 112.326 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -137.9 11.47 2.88 Favored 'General case' 0 C--O 1.218 -0.583 0 C-N-CA 120.396 -0.521 . . . . 0.0 111.549 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.433 HD13 ' HD2' ' A' ' 683' ' ' ARG . 16.8 pt -65.05 -43.3 95.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 87.9 mtm-85 -59.69 -46.18 89.85 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.105 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.487 HD12 ' N ' ' B' ' 684' ' ' ILE . 2.0 mp -68.33 -39.22 80.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.132 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -62.27 -51.16 68.82 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.521 HG21 HD12 ' C' ' 686' ' ' ILE . 2.6 mp -65.14 -39.82 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.491 -178.526 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 80.4 mt -58.75 -41.71 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.855 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 55.3 mt -58.54 -41.63 82.41 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 61.2 t -67.79 -29.4 44.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.878 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.92 -43.33 96.82 Favored Glycine 0 C--N 1.35 1.351 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -34.09 73.81 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.312 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 3.7 tp -63.53 -43.38 97.3 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.944 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.49 HG12 HD13 ' A' ' 693' ' ' ILE . 0.4 OUTLIER -66.13 -39.1 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.822 -179.138 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.81 -42.09 87.28 Favored Glycine 0 CA--C 1.531 1.045 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.15 -31.44 63.35 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 120.743 0.306 . . . . 0.0 110.31 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.555 ' CG ' HD11 ' A' ' 693' ' ' ILE . 2.0 tpm_? -50.71 -31.9 17.88 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 122.814 0.446 . . . . 0.0 111.896 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 45.5 mt -60.17 -42.87 91.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.356 -177.59 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.524 ' O ' HG22 ' B' ' 701' ' ' VAL . 44.2 t -57.0 -28.94 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.517 -178.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -25.41 39.91 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.215 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.72 -35.52 22.29 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 701' ' ' VAL . . . . . 0.524 HG22 ' O ' ' B' ' 698' ' ' VAL . 33.8 m -59.82 -32.03 48.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 120.07 -0.652 . . . . 0.0 110.668 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 20.0 tp -60.26 -38.3 83.09 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.799 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 6.4 t -57.93 -38.87 76.7 Favored 'General case' 0 C--O 1.22 -0.479 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.975 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.9 tp -65.78 -42.8 90.36 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.072 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 39.8 t -71.25 -23.72 23.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.601 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.69 -14.82 62.03 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.16 -30.97 17.28 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.531 -179.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 34.8 m -88.39 -25.61 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.492 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -96.79 140.04 31.95 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.742 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.758 179.944 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.416 HD13 ' HZ2' ' B' ' 670' ' ' TRP . 23.1 tp . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 tp -143.49 113.39 7.15 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -146.09 163.76 34.28 Favored 'General case' 0 C--O 1.218 -0.582 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.744 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.425 HD23 ' HB3' ' A' ' 661' ' ' LEU . 10.5 mt -61.42 -38.78 88.35 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.851 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.87 -28.62 62.61 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.534 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -70.23 -44.13 69.21 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.154 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 666' ' ' TRP . . . . . 0.46 ' CD1' HD22 ' A' ' 661' ' ' LEU . 78.6 m95 -60.56 -57.05 14.37 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.368 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.57 -47.02 77.09 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.146 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 78.6 p -60.2 -31.94 70.63 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 123.224 0.328 . . . . 0.0 111.179 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 11.9 tp -64.19 -4.64 3.82 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -68.27 -6.59 24.65 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.818 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -63.17 -37.06 85.73 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -79.84 -22.68 42.69 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -176.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 64.23 -71.42 0.07 Allowed 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.198 1.363 . . . . 0.0 112.462 178.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -50.84 -49.69 58.32 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 46.1 mm -65.96 -40.53 87.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.666 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.2 m -58.93 -49.82 76.38 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.146 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -67.74 -40.53 84.15 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.516 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -60.53 -36.84 79.38 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.531 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 5.9 tp -76.9 -14.25 59.9 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 3.3 t90 -111.16 -19.12 12.82 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -95.0 -38.25 10.75 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.626 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 47.5 mm -57.57 -36.9 55.67 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.512 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.659 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.7 -33.91 66.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.06 178.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -68.0 -41.58 84.67 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -56.25 -28.05 57.17 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.883 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.521 HD12 HG21 ' B' ' 686' ' ' ILE . 36.8 mm -58.2 -45.44 88.84 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.577 -177.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 41.1 mt -65.42 -40.79 89.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 21.2 mm -55.95 -41.13 66.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.496 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.734 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 61.3 t -67.12 -23.66 30.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 120.033 -0.667 . . . . 0.0 111.942 -178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 690' ' ' GLY . . . . . 0.59 ' O ' HG22 ' C' ' 693' ' ' ILE . . . -59.63 -51.35 59.55 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-N 119.189 0.904 . . . . 0.0 111.555 179.204 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 2.0 m -72.72 -21.89 60.97 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 117.247 0.523 . . . . 0.0 112.181 -179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.7 tp -55.95 -38.27 70.11 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.888 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.747 HD11 ' HG3' ' A' ' 696' ' ' ARG . 0.0 OUTLIER -73.77 -23.03 18.89 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.579 -179.801 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.48 -47.43 89.91 Favored Glycine 0 CA--C 1.542 1.76 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.102 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.506 HD23 ' O ' ' C' ' 695' ' ' LEU . 1.0 OUTLIER -56.54 -30.69 63.37 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.257 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -49.65 -34.92 19.69 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -177.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.593 HD13 ' NH2' ' A' ' 696' ' ' ARG . 7.2 tp -58.17 -40.27 76.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -175.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.456 HG12 ' O ' ' C' ' 695' ' ' LEU . 9.6 p -55.72 -28.55 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 CA-C-N 118.968 0.804 . . . . 0.0 111.449 -178.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -55.65 -35.32 65.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.37 -35.97 65.85 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.318 -177.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 77.5 t -64.73 -31.66 54.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 120.181 -0.608 . . . . 0.0 109.77 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.9 tp -58.83 -40.76 85.13 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.77 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 95.1 p -62.32 -33.92 75.61 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.141 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 19.5 tp -60.39 -42.9 96.86 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.13 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 27.2 m -83.2 -11.53 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.735 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -67.38 -21.05 65.63 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.45 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -73.53 -39.64 64.62 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.498 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 46.4 t -89.4 -35.94 8.16 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.236 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 . . . . . 0 C--O 1.219 -0.518 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.308 -179.944 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.444 ' O ' ' O ' ' A' ' 661' ' ' LEU . 3.0 mp . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.467 ' O ' HD12 ' C' ' 663' ' ' LEU . 3.9 pp 39.75 -176.16 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 172.73 -179.07 0.07 Allowed 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.128 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.689 ' O ' HD22 ' A' ' 663' ' ' LEU . 0.0 OUTLIER -58.88 -40.59 84.84 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-O 120.791 0.329 . . . . 0.0 110.244 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 664' ' ' ASP . . . . . 0.689 ' N ' HD13 ' A' ' 663' ' ' LEU . 37.0 t70 -73.94 -23.97 59.59 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.851 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -67.06 -45.45 77.33 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.293 -179.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -64.47 -38.61 91.64 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.978 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 667' ' ' ALA . . . . . 0.675 ' HB2' ' CD1' ' B' ' 660' ' ' LEU . . . -72.8 -47.18 48.66 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.508 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 89.9 p -59.58 -31.64 69.63 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.038 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.611 HD11 HG22 ' A' ' 675' ' ' ILE . 56.6 tp -56.47 -26.78 55.15 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.062 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -68.54 -9.95 52.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 119.512 -0.875 . . . . 0.0 111.997 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -62.76 -48.85 77.37 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.583 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.68 -22.57 13.55 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.347 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 48.2 p90 41.39 22.05 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -63.89 -52.8 58.28 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.782 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.611 HG22 HD11 ' A' ' 669' ' ' LEU . 0.3 OUTLIER -68.67 -33.22 58.49 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.748 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.581 -179.202 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 51.7 p -58.44 -37.78 76.13 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.619 -178.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -60.57 -41.64 95.03 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.344 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 7.0 t90 -72.81 -46.42 53.22 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 679' ' ' LEU . 0.6 OUTLIER -91.54 -33.46 15.15 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.593 0.961 . . . . 0.0 113.593 -176.138 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.15 -11.02 60.38 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.287 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -110.16 -30.1 7.89 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 121.093 -0.243 . . . . 0.0 110.603 179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.442 ' O ' HD13 ' A' ' 686' ' ' ILE . 1.2 mm -60.0 -43.83 93.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 45.9 ttp180 -62.2 -48.45 79.95 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.244 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 80.0 mt -64.12 -44.06 97.55 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.454 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -52.65 -27.83 18.93 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.771 HG21 HD11 ' B' ' 686' ' ' ILE . 1.2 mp -57.54 -48.38 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.218 -177.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 49.1 mt -58.59 -41.92 83.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.321 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 69.1 mt -60.19 -45.18 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.9 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 13.4 m -68.81 2.0 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 119.811 -0.755 . . . . 0.0 112.27 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -85.6 -64.2 1.51 Allowed Glycine 0 C--N 1.347 1.173 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 29.8 m -52.1 -25.16 8.12 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.611 -0.435 . . . . 0.0 110.683 178.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.636 HD23 HD11 ' C' ' 693' ' ' ILE . 2.3 tp -54.03 -32.58 54.79 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.785 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -35.39 73.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.156 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.919 -178.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.02 -56.28 5.87 Favored Glycine 0 CA--C 1.537 1.43 0 C-N-CA 120.007 -1.092 . . . . 0.0 113.767 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.753 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.0 OUTLIER -60.36 -31.6 70.48 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.992 1.396 . . . . 0.0 110.456 179.905 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.529 ' H ' HD13 ' A' ' 695' ' ' LEU . 20.1 tpp180 -50.74 -35.88 33.68 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-O 120.723 0.297 . . . . 0.0 110.348 177.621 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 58.1 mt -59.21 -40.35 80.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.782 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.753 HG12 ' O ' ' A' ' 695' ' ' LEU . 3.5 p -55.55 -28.06 22.27 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.807 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.347 -178.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -55.04 -35.4 64.42 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.929 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.78 -35.59 66.43 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.911 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.664 HG12 ' O ' ' A' ' 698' ' ' VAL . 1.7 p -59.88 -34.2 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.075 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.05 -24.84 67.86 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.284 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 32.1 m -57.87 -44.75 86.83 Favored 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.778 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.54 -40.39 92.84 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 61.6 t -60.61 -28.33 42.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.342 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -63.33 -7.33 6.13 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 11.2 ttp85 -73.6 -44.82 56.18 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.485 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 43.0 t -89.42 -36.03 8.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.219 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 38.23 46.99 0.94 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 58.3 tp60 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.017 -0.992 . . . . 0.0 111.037 179.753 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.675 ' CD1' ' HB2' ' A' ' 667' ' ' ALA . 55.8 mt . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.642 ' H ' HD23 ' A' ' 663' ' ' LEU . 0.2 OUTLIER -146.84 135.36 21.97 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.287 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -168.75 137.99 2.23 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.579 ' C ' HD22 ' B' ' 663' ' ' LEU . 0.0 OUTLIER -55.01 -18.25 4.89 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.356 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -72.48 -31.46 65.4 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 121.058 -0.257 . . . . 0.0 110.753 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -69.43 -44.91 70.36 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.369 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 85.4 m95 -66.23 -38.84 88.88 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.355 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.4 -35.83 71.17 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.144 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 2.9 t -54.98 -31.44 60.86 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.075 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.421 HD22 ' CH2' ' B' ' 672' ' ' TRP . 8.7 mt -62.9 -14.8 50.95 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.934 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -68.79 -28.27 66.62 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.962 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -62.83 -47.93 81.26 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.508 -0.477 . . . . 0.0 112.197 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 672' ' ' TRP . . . . . 0.59 ' CZ3' HG22 ' B' ' 675' ' ' ILE . 0.0 OUTLIER -103.44 -22.46 13.65 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.717 -178.988 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 53.45 7.83 0.11 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -63.45 -53.22 55.63 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.291 0.95 . . . . 0.0 112.276 -178.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.59 HG22 ' CZ3' ' B' ' 672' ' ' TRP . 8.8 tp -68.97 -32.8 55.98 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.75 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.632 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -59.02 -46.77 87.36 Favored 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.441 -178.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -64.68 -46.67 81.45 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.823 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.556 ' CE3' HD12 ' B' ' 675' ' ' ILE . 5.4 t90 -65.18 -38.19 89.74 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.088 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 679' ' ' LEU . . . . . 0.401 HD13 ' O ' ' B' ' 679' ' ' LEU . 0.1 OUTLIER -87.42 -19.34 28.2 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.717 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -100.61 9.68 42.17 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.619 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -129.99 -1.24 4.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.525 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.412 ' O ' HD12 ' B' ' 686' ' ' ILE . 12.7 tt -68.46 -44.18 83.4 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 17.1 ttm105 -55.81 -47.89 76.37 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.498 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 684' ' ' ILE . . . . . 0.5 HD12 ' N ' ' B' ' 684' ' ' ILE . 2.2 mp -64.54 -36.92 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.773 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.448 ' O ' HG23 ' B' ' 689' ' ' VAL . 46.1 t80 -52.01 -39.09 58.94 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 119.101 -0.476 . . . . 0.0 112.26 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.771 HD11 HG21 ' A' ' 686' ' ' ILE . 3.2 mp -60.27 -38.55 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 119.79 -0.764 . . . . 0.0 109.956 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.77 -41.91 83.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 688' ' ' ILE . . . . . 0.568 ' H ' HD12 ' B' ' 688' ' ' ILE . 3.8 mp -66.69 -42.19 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.521 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.461 ' O ' HG12 ' B' ' 689' ' ' VAL . 66.1 t -68.52 -1.78 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.202 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.151 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -91.75 -45.57 3.92 Favored Glycine 0 C--N 1.35 1.343 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 27.3 m -53.52 -30.13 39.96 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.121 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 8.4 mp -61.71 -36.3 80.52 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.034 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.747 HG21 HD23 ' C' ' 692' ' ' LEU . 0.3 OUTLIER -59.27 -33.37 50.66 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 120.164 -0.614 . . . . 0.0 110.756 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -70.03 -36.46 72.63 Favored Glycine 0 CA--C 1.534 1.241 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 179.311 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.54 ' O ' HG22 ' B' ' 698' ' ' VAL . 1.0 OUTLIER -56.14 -31.6 63.49 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.426 -178.85 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.16 -31.56 13.89 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.602 HD11 ' NH2' ' C' ' 696' ' ' ARG . 48.7 mm -59.91 -48.29 88.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.427 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.54 HG22 ' O ' ' B' ' 695' ' ' LEU . 16.1 m -66.75 -28.36 42.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.752 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -55.49 -26.82 44.77 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.623 -179.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.6 -40.68 79.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.459 -0.496 . . . . 0.0 109.875 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 63.0 t -64.49 -42.62 95.76 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.11 -38.64 89.66 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.472 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 68.1 m -57.91 -34.54 69.95 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.963 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.8 tp -66.1 -42.1 89.7 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.995 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.69 -17.43 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.915 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -60.96 -26.2 67.37 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.465 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -73.79 -36.45 65.04 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.851 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 43.0 t -82.91 -36.13 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.273 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 66.3 mtm180 -144.01 130.92 20.39 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.709 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 C--O 1.22 -0.479 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.648 -179.97 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 3.1 tt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 28.3 mt -136.27 132.04 35.22 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -170.6 -176.51 2.12 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.099 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.467 HD12 ' O ' ' A' ' 661' ' ' LEU . 8.1 tt -52.45 -31.39 34.47 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.371 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -71.21 -40.35 71.2 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.707 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.7 mmtt -70.22 -43.51 70.5 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.169 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -60.24 -44.67 95.03 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.96 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.63 -41.04 88.93 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.534 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 20.1 m -56.58 -31.94 64.73 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.269 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 9.2 tp -70.48 -4.72 24.15 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -72.71 -13.77 61.41 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -178.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -62.77 -50.42 71.12 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 118.291 -1.364 . . . . 0.0 110.593 -178.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 672' ' ' TRP . . . . . 0.415 ' O ' ' N ' ' C' ' 674' ' ' ASP . 0.3 OUTLIER -101.75 -23.35 14.22 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 178.881 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 49.0 p90 42.01 9.19 0.0 OUTLIER 'General case' 0 C--N 1.362 1.128 0 N-CA-C 116.408 2.003 . . . . 0.0 116.408 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 674' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' C' ' 672' ' ' TRP . 30.2 t70 -64.22 -53.97 40.9 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 120.156 1.344 . . . . 0.0 110.662 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 9.3 tp -69.88 -29.67 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.454 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 17.3 m -58.45 -40.02 81.5 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.504 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.43 -46.31 90.5 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 119.964 -0.694 . . . . 0.0 109.564 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.482 ' O ' HG22 ' C' ' 682' ' ' ILE . 28.3 t90 -56.84 -39.09 73.6 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.259 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.01 -2.87 42.31 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -179.401 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 4.7 t90 -146.83 44.06 1.17 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 119.772 -0.771 . . . . 0.0 112.325 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -161.18 -42.32 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.725 ' O ' HD13 ' C' ' 682' ' ' ILE . 0.1 OUTLIER -55.88 -36.91 45.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.49 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 3.5 ptt-85 -55.81 -40.73 73.16 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 40.5 mm -59.85 -41.3 85.3 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.49 ' HA ' HD13 ' C' ' 688' ' ' ILE . 1.3 t80 -67.09 -27.77 67.63 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.807 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.685 ' CG2' HD11 ' A' ' 686' ' ' ILE . 1.1 tp -57.89 -43.6 84.83 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.727 -177.695 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 39.2 mt -59.27 -41.64 84.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.027 -179.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.591 ' H ' HD12 ' C' ' 688' ' ' ILE . 3.4 mp -56.82 -41.5 75.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 52.4 t -67.67 -31.38 52.2 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.126 0 CA-C-O 118.684 -0.674 . . . . 0.0 112.197 -177.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -62.74 -53.48 40.83 Favored Glycine 0 CA--C 1.538 1.491 0 CA-C-N 119.415 1.007 . . . . 0.0 111.632 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.5 m -61.83 -24.39 66.86 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 117.231 0.515 . . . . 0.0 112.377 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 692' ' ' LEU . . . . . 0.747 HD23 HG21 ' B' ' 693' ' ' ILE . 2.5 tp -54.22 -32.63 56.36 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.711 -178.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.636 HD11 HD23 ' A' ' 692' ' ' LEU . 2.3 pp -70.19 -28.07 34.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 120.259 -0.576 . . . . 0.0 111.134 -178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.71 -55.27 23.57 Favored Glycine 0 CA--C 1.542 1.778 0 C-N-CA 121.182 -0.532 . . . . 0.0 113.125 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.3 tt -58.42 -36.45 73.63 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.602 ' NH2' HD11 ' B' ' 697' ' ' ILE . 0.3 OUTLIER -50.56 -35.85 31.78 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -178.725 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.62 ' O ' HD13 ' C' ' 697' ' ' ILE . 0.2 OUTLIER -59.18 -41.02 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.18 -178.177 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.772 ' O ' HG12 ' C' ' 701' ' ' VAL . 64.9 t -56.49 -29.0 27.91 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.827 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -56.05 -35.25 66.7 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.35 -34.93 64.69 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.103 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 701' ' ' VAL . . . . . 0.772 HG12 ' O ' ' C' ' 698' ' ' VAL . 9.3 p -59.06 -31.53 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.5 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.59 -30.54 67.27 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.391 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.3 t -57.93 -39.0 76.95 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.849 -0.341 . . . . 0.0 110.428 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 16.3 tp -56.51 -31.21 63.87 Favored 'General case' 0 C--O 1.218 -0.588 0 C-N-CA 120.635 -0.426 . . . . 0.0 109.871 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.8 t -75.66 -17.57 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.042 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -60.66 -22.36 63.77 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.18 -3.7 58.9 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 120.625 -0.43 . . . . 0.0 112.018 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 48.3 t -104.41 -36.03 3.77 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.534 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.319 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 . . . . . 0 C--O 1.217 -0.652 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.959 -179.871 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.513 HD23 ' N ' ' A' ' 660' ' ' LEU . 1.4 pt? . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 9.5 mp -99.72 155.38 17.66 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.252 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -163.51 159.78 22.42 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.758 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 8.9 tt -61.83 -40.53 95.61 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.775 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -72.68 -23.91 60.94 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.478 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -64.41 -40.0 94.93 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.914 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -70.25 -49.61 48.14 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.148 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.81 -31.38 72.32 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.48 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 1.8 m -57.43 -31.59 66.05 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.112 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 70.4 mt -71.27 -4.83 27.97 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -68.98 -1.0 6.37 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -62.32 -49.17 76.69 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 118.41 -1.316 . . . . 0.0 111.887 -176.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -104.23 -11.04 17.46 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.832 177.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.3 p90 43.33 18.84 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -64.42 -52.93 55.61 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.507 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.547 HD11 ' CE3' ' A' ' 678' ' ' TRP . 7.1 tp -68.84 -28.35 39.41 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.316 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 75.7 p -58.9 -40.35 84.2 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 119.818 -0.753 . . . . 0.0 109.386 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -65.33 -33.83 76.9 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.807 178.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.638 ' CD1' HG21 ' A' ' 682' ' ' ILE . 42.3 t90 -69.83 -44.56 69.72 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.868 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.68 -2.6 7.17 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.222 -178.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -136.48 -58.43 0.74 Allowed 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 119.723 -0.791 . . . . 0.0 112.874 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -72.52 -41.44 65.88 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 120.482 -0.487 . . . . 0.0 112.258 -177.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.638 HG21 ' CD1' ' A' ' 678' ' ' TRP . 28.9 mm -67.26 -36.44 76.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -55.29 -48.03 74.68 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.185 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.91 -43.14 91.52 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 C-N-CA 120.991 -0.283 . . . . 0.0 111.178 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.425 ' HA ' HD13 ' A' ' 688' ' ' ILE . 3.2 t80 -52.57 -28.71 22.1 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -177.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.53 HG12 HG21 ' C' ' 686' ' ' ILE . 1.4 mp -57.95 -37.83 63.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 CA-C-O 119.188 -0.434 . . . . 0.0 111.18 -179.11 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.11 -41.95 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.077 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 688' ' ' ILE . . . . . 0.581 HD12 ' H ' ' A' ' 688' ' ' ILE . 5.1 mp -64.56 -40.97 90.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.765 ' O ' HD11 ' A' ' 692' ' ' LEU . 21.9 t -68.32 4.38 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -178.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -110.71 -5.77 27.29 Favored Glycine 0 CA--C 1.543 1.828 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 178.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 54.2 m -88.24 -32.84 18.33 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 117.141 0.471 . . . . 0.0 111.343 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.765 HD11 ' O ' ' A' ' 689' ' ' VAL . 0.2 OUTLIER -53.67 -32.6 52.29 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.089 -178.237 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.734 HD13 ' O ' ' A' ' 693' ' ' ILE . 0.1 OUTLIER -54.82 -34.18 29.98 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 120.3 -0.56 . . . . 0.0 109.898 179.692 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.42 -43.82 36.22 Favored Glycine 0 C--N 1.346 1.117 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 177.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.437 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.4 OUTLIER -56.43 -37.43 70.2 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.151 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -50.68 -35.37 30.58 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 122.776 0.431 . . . . 0.0 111.152 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 75.2 mt -59.31 -41.97 85.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 CA-C-O 118.994 -0.527 . . . . 0.0 111.214 -176.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.437 HG12 ' O ' ' A' ' 695' ' ' LEU . 2.4 p -67.6 -28.49 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 118.956 0.798 . . . . 0.0 111.074 179.285 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -55.06 -35.01 64.06 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.461 0.172 . . . . 0.0 110.642 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.42 -35.49 65.44 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.895 -178.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 698' ' ' VAL . 0.5 OUTLIER -60.59 -38.23 77.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.758 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 702' ' ' LEU . . . . . 0.427 ' O ' HG22 ' A' ' 705' ' ' VAL . 0.0 OUTLIER -61.62 -29.07 69.81 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.755 -179.847 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 4.0 t -63.62 -31.91 73.22 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.101 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 30.6 tp -62.73 -39.52 94.35 Favored 'General case' 0 C--O 1.218 -0.588 0 O-C-N 123.102 0.251 . . . . 0.0 111.085 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 705' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 702' ' ' LEU . 35.1 m -82.65 -10.8 12.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -63.81 -24.06 67.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 120.725 -0.39 . . . . 0.0 112.027 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 12.6 ptt-85 -76.6 -19.13 58.18 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 120.378 -0.529 . . . . 0.0 112.305 -179.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 6.7 m -104.99 26.05 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 55.2 mtm180 -86.53 152.95 22.2 Favored 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.572 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.068 -0.967 . . . . 0.0 110.917 -179.908 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.411 ' O ' HD12 ' B' ' 660' ' ' LEU . 3.6 pp . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.513 HD22 ' CZ2' ' B' ' 666' ' ' TRP . 70.2 mt -124.65 154.61 40.48 Favored 'General case' 0 C--O 1.22 -0.479 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.101 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -147.83 145.87 28.89 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.783 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.43 ' O ' HD23 ' B' ' 663' ' ' LEU . 4.6 tt -54.95 -40.01 69.52 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 121.016 0.436 . . . . 0.0 110.325 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.57 -35.46 77.43 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.701 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -68.14 -43.04 79.21 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.45 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 666' ' ' TRP . . . . . 0.513 ' CZ2' HD22 ' B' ' 661' ' ' LEU . 83.3 m95 -59.75 -48.71 80.59 Favored 'General case' 0 C--O 1.22 -0.449 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.374 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -54.23 -33.03 57.47 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.757 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.51 -32.97 69.32 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.098 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.789 HD11 HG23 ' B' ' 675' ' ' ILE . 49.0 tp -59.53 -17.34 31.43 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.712 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -68.64 -17.07 64.03 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -89.46 -16.65 30.34 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -86.49 -22.66 26.3 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.32 -177.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 41.0 t80 59.87 -73.06 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -51.44 -53.01 41.37 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -176.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.789 HG23 HD11 ' B' ' 669' ' ' LEU . 5.0 tp -68.27 -27.93 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 119.829 -0.749 . . . . 0.0 110.777 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.3 m -63.25 -48.28 78.88 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.589 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -71.24 -41.36 70.23 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.785 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.571 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.5 t90 -62.81 -44.22 96.74 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.331 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 679' ' ' LEU . . . . . 0.453 HD13 HD11 ' B' ' 675' ' ' ILE . 0.5 OUTLIER -75.78 -27.51 58.04 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.557 -178.126 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.6 t90 -91.89 0.02 57.49 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -119.0 -6.28 10.5 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.626 -0.43 . . . . 0.0 112.092 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.571 HG23 ' O ' ' B' ' 678' ' ' TRP . 7.8 pt -63.44 -42.65 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.669 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -43.95 77.01 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.769 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 56.8 mt -66.65 -37.74 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 178.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -55.8 -29.97 60.59 Favored 'General case' 0 C--O 1.218 -0.601 0 C-N-CA 121.112 -0.235 . . . . 0.0 111.47 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.599 HG21 HG13 ' C' ' 686' ' ' ILE . 27.2 mm -60.02 -41.84 87.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.45 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.82 -41.82 83.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 688' ' ' ILE . . . . . 0.516 ' N ' HD12 ' B' ' 688' ' ' ILE . 2.8 mp -61.93 -42.33 94.31 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.463 ' O ' HG12 ' B' ' 689' ' ' VAL . 60.0 t -68.64 -2.14 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.237 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 690' ' ' GLY . . . . . 0.49 ' O ' HG22 ' B' ' 693' ' ' ILE . . . -86.33 -55.83 2.4 Favored Glycine 0 C--N 1.351 1.368 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 21.9 m -58.08 -30.79 66.5 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.741 179.216 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.3 tp -54.71 -34.35 62.26 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.772 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.679 HD11 ' HG3' ' C' ' 696' ' ' ARG . 0.3 OUTLIER -73.91 -27.76 23.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 120.349 -0.541 . . . . 0.0 111.321 -179.334 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.86 -41.65 87.85 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.53 -31.79 64.48 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 121.249 -0.18 . . . . 0.0 111.021 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.98 -30.94 16.39 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 58.9 mt -59.44 -41.53 84.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.085 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 47.4 t -65.28 -28.59 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.496 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.47 -26.66 43.69 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.035 -179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -51.37 -37.04 46.01 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.735 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.27 -42.42 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.547 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.53 -29.09 69.78 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.035 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 20.9 t -57.98 -32.35 67.79 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.609 -0.437 . . . . 0.0 111.279 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 26.1 tp -66.08 -40.94 91.22 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.241 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -64.63 -25.62 38.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.788 0 C-N-CA 120.726 -0.389 . . . . 0.0 110.17 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -67.27 -13.07 61.64 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.433 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.26 -31.74 13.33 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 120.396 0.141 . . . . 0.0 110.671 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.539 ' O ' HG12 ' B' ' 708' ' ' VAL . 20.4 t -87.79 25.96 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.398 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -50.61 117.89 2.73 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 122.148 -0.345 . . . . 0.0 111.29 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.369 -179.998 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.51 ' O ' HD12 ' C' ' 661' ' ' LEU . 4.2 pp -162.58 151.25 14.75 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 120.807 0.337 . . . . 0.0 111.219 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -171.26 179.25 3.04 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.903 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.11 -30.99 71.4 Favored 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.449 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.49 -36.44 78.93 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.651 -0.419 . . . . 0.0 110.845 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 59.1 mmtt -70.43 -42.37 71.66 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.369 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -70.4 -53.99 14.25 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.62 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.58 -37.51 75.93 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.4 t -62.83 -33.46 75.28 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.844 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 669' ' ' LEU . . . . . 0.581 HD21 HG23 ' C' ' 675' ' ' ILE . 19.9 tp -70.99 -5.28 29.95 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -68.58 -6.11 23.68 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -79.9 -49.64 11.62 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 119.567 -0.853 . . . . 0.0 113.269 -178.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -89.94 -23.77 21.48 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 114.738 1.384 . . . . 0.0 114.738 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 55.17 -10.26 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 178.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -63.9 -54.53 33.28 Favored 'General case' 0 C--N 1.352 0.715 0 CA-C-N 120.465 1.484 . . . . 0.0 112.381 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.581 HG23 HD21 ' C' ' 669' ' ' LEU . 7.9 tp -70.14 -32.81 52.31 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.962 178.197 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -58.77 -39.07 79.93 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.916 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -59.73 -47.51 85.36 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 120.365 -0.534 . . . . 0.0 109.692 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 19.5 t90 -72.61 -28.27 62.67 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.132 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.419 HD23 HG13 ' C' ' 675' ' ' ILE . 0.2 OUTLIER -67.45 -4.05 10.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.521 -179.113 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -142.48 -179.09 6.09 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 64.58 -11.3 0.13 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.01 -37.07 59.18 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 CA-C-N 119.444 1.02 . . . . 0.0 110.5 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 41.0 mtt85 -60.71 -48.3 82.41 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.886 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.537 ' O ' HD12 ' C' ' 688' ' ' ILE . 97.4 mt -62.7 -44.07 99.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.725 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.434 ' HA ' HD13 ' C' ' 688' ' ' ILE . 0.1 OUTLIER -63.76 -28.53 69.94 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.484 0.49 . . . . 0.0 110.154 178.915 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.599 HG13 HG21 ' B' ' 686' ' ' ILE . 0.9 OUTLIER -58.64 -38.77 73.34 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.832 -178.659 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 45.7 mt -67.11 -42.92 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.268 -178.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.537 HD12 ' O ' ' C' ' 684' ' ' ILE . 4.0 mp -57.97 -41.06 79.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-O 119.477 -0.297 . . . . 0.0 111.772 -178.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.598 ' O ' HD11 ' C' ' 692' ' ' LEU . 38.3 t -67.56 -20.06 25.91 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -176.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -90.77 14.38 63.28 Favored Glycine 0 CA--C 1.545 1.942 0 CA-C-N 119.994 1.27 . . . . 0.0 113.409 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.6 m -88.68 -34.25 17.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.365 1.083 . . . . 0.0 112.418 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 692' ' ' LEU . . . . . 0.598 HD11 ' O ' ' C' ' 689' ' ' VAL . 0.2 OUTLIER -61.16 -33.09 72.86 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.982 -178.369 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.525 ' H ' HD12 ' C' ' 692' ' ' LEU . 2.1 pp -57.81 -40.05 74.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 119.794 -0.762 . . . . 0.0 110.267 -178.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.9 -53.36 46.98 Favored Glycine 0 CA--C 1.539 1.593 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 7.7 tt -56.63 -31.6 64.49 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.679 ' HG3' HD11 ' B' ' 693' ' ' ILE . 23.6 mmt180 -50.55 -36.52 34.83 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 -178.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.63 ' O ' HD13 ' C' ' 697' ' ' ILE . 0.2 OUTLIER -59.67 -41.64 85.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.582 -177.615 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.6 -28.87 45.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.64 -35.16 73.84 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.667 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.3 -35.41 65.06 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.148 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 80.4 t -59.54 -31.41 46.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.029 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.4 tp -58.34 -34.29 70.47 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.418 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 29.2 p -58.0 -37.61 74.6 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.561 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.8 tp -57.59 -39.9 77.84 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.671 -0.411 . . . . 0.0 109.946 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 28.9 t -72.82 -31.43 36.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.702 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -60.92 -8.82 3.43 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -109.65 -32.84 6.96 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 39.8 t -82.94 -29.13 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.835 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 . . . . . 0 C--O 1.219 -0.512 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.042 -179.854 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.511 ' N ' HD22 ' A' ' 660' ' ' LEU . 3.6 mm? . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.679 ' O ' HD23 ' C' ' 663' ' ' LEU . 44.4 mt 60.23 115.31 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.144 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -165.65 168.5 16.21 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.208 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.522 HD23 ' O ' ' A' ' 663' ' ' LEU . 5.3 tt -52.52 -38.82 60.47 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.823 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.15 -34.62 68.65 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.518 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -68.18 -44.32 76.16 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.356 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -58.7 -44.1 90.24 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-O 120.815 0.34 . . . . 0.0 110.942 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 667' ' ' ALA . . . . . 0.462 ' CB ' HD22 ' B' ' 660' ' ' LEU . . . -51.68 -19.66 1.69 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.142 -178.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 32.1 t -64.69 -32.65 74.42 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.421 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 669' ' ' LEU . 4.2 mm? -69.82 -20.49 63.44 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -68.89 -17.22 63.94 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.905 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -63.24 -35.49 80.52 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 3.9 m95 -94.84 -23.44 17.48 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 119.76 -0.776 . . . . 0.0 111.099 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 18.5 t80 66.8 -41.74 0.4 Allowed 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 178.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -52.09 64.32 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -177.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.474 HD11 ' CE3' ' A' ' 678' ' ' TRP . 8.1 tp -62.92 -29.91 48.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.719 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.177 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.4 m -59.69 -37.57 79.16 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.835 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -66.27 -23.16 66.35 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.503 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.474 ' CE3' HD11 ' A' ' 675' ' ' ILE . 4.9 t90 -72.05 -46.4 57.14 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.225 -179.135 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.11 -24.45 19.12 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -177.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -74.07 -0.59 16.96 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 119.397 -0.921 . . . . 0.0 111.607 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -128.31 -25.07 3.01 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.617 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.4 tt -55.56 -36.6 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.874 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 26.9 ttp-105 -55.84 -48.42 75.52 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 29.3 mt -64.89 -45.97 93.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -52.83 -33.22 48.39 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.9 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.485 HG13 HG21 ' C' ' 686' ' ' ILE . 1.1 mp -58.4 -42.81 85.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 3.7 mm -58.44 -42.14 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 119.907 -0.717 . . . . 0.0 109.564 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 41.8 mm -57.08 -41.01 76.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-N 116.965 -0.107 . . . . 0.0 110.958 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.488 ' O ' HG12 ' A' ' 689' ' ' VAL . 42.8 t -67.75 -0.09 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 C-N-CA 120.158 -0.617 . . . . 0.0 111.495 -178.134 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.97 -40.23 8.18 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 177.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 4.3 m -77.86 -16.92 57.91 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.461 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.5 tp -58.83 -44.04 90.8 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.171 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.729 HD13 ' O ' ' A' ' 693' ' ' ILE . 0.2 OUTLIER -63.0 -30.48 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.231 179.43 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.55 -37.82 78.34 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.335 -1.506 . . . . 0.0 109.335 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.641 ' O ' HG22 ' A' ' 698' ' ' VAL . 0.4 OUTLIER -56.57 -35.97 68.78 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 120.572 0.225 . . . . 0.0 110.752 179.172 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.645 ' HG2' HD11 ' C' ' 693' ' ' ILE . 0.0 OUTLIER -50.55 -33.89 23.48 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 123.249 0.62 . . . . 0.0 111.479 178.308 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 77.3 mt -57.8 -40.08 74.13 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.457 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 695' ' ' LEU . 16.8 m -55.62 -28.21 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 119.227 0.921 . . . . 0.0 110.77 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.451 ' HA ' ' HB3' ' A' ' 702' ' ' LEU . 28.9 m-85 -55.45 -36.43 66.53 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.58 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.77 -48.02 78.83 Favored 'General case' 0 C--O 1.219 -0.553 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.92 -43.78 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 702' ' ' LEU . . . . . 0.451 ' HB3' ' HA ' ' A' ' 699' ' ' PHE . 0.6 OUTLIER -58.88 -24.81 62.72 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.729 178.629 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.7 -43.16 94.22 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.376 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.0 tp -65.27 -36.71 84.93 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-O 121.085 0.469 . . . . 0.0 110.062 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.61 -36.1 68.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.052 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.88 -8.74 3.34 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.888 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.95 -45.64 49.03 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 120.594 0.235 . . . . 0.0 111.038 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 708' ' ' VAL . 6.9 t -98.78 26.49 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.563 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -36.16 146.26 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 . . . . . 0 C--O 1.219 -0.528 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.164 -179.245 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.477 ' HB2' HD21 ' A' ' 663' ' ' LEU . 39.6 mt . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 49.47 -152.04 0.15 Allowed 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 662' ' ' GLU . . . . . 0.4 ' HB2' ' HB2' ' B' ' 665' ' ' LYS . 9.8 pt-20 -170.49 65.7 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.32 0.509 . . . . 0.0 111.272 -178.077 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.614 ' O ' HD23 ' B' ' 663' ' ' LEU . 5.8 tt -66.88 -41.11 87.76 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 119.981 -0.688 . . . . 0.0 111.974 -179.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -74.58 -29.28 61.27 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.092 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 665' ' ' LYS . . . . . 0.4 ' HB2' ' HB2' ' B' ' 662' ' ' GLU . 1.1 tptm -70.46 -25.46 63.19 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 118.889 -0.577 . . . . 0.0 111.917 -178.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 666' ' ' TRP . . . . . 0.727 ' CG ' HD12 ' C' ' 661' ' ' LEU . 91.9 m95 -58.91 -50.7 73.05 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 119.051 -1.059 . . . . 0.0 108.435 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.65 -41.89 95.8 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.996 -178.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 37.9 m -65.85 -31.74 72.87 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.52 -0.472 . . . . 0.0 109.911 178.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 29.8 mt -72.46 -4.98 33.61 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.155 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -68.41 -3.0 9.74 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.574 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 29.6 m-20 -89.38 -12.71 39.6 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -178.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -88.92 -22.75 22.95 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.716 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 60.0 -72.38 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -51.74 -52.31 49.63 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.511 HD13 ' O ' ' B' ' 675' ' ' ILE . 0.3 OUTLIER -68.27 -31.12 50.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 119.571 -0.852 . . . . 0.0 110.569 -179.31 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.9 m -58.74 -43.21 90.17 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -60.96 -37.83 83.77 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.108 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -71.63 -42.08 68.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.045 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.13 -6.57 18.2 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 119.367 -0.933 . . . . 0.0 111.114 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 680' ' ' TRP . . . . . 0.409 ' O ' ' HB2' ' B' ' 681' ' ' TYR . 1.9 t90 -129.61 176.4 8.02 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 177.538 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 681' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' B' ' 680' ' ' TRP . 96.7 m-85 72.36 -19.48 0.29 Allowed 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 27.2 pt -55.76 -37.05 45.37 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 CA-C-N 118.169 0.44 . . . . 0.0 110.453 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -45.65 91.26 Favored 'General case' 0 C--O 1.219 -0.541 0 O-C-N 123.102 0.251 . . . . 0.0 110.408 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 38.1 mt -67.15 -38.08 80.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.43 -28.87 60.73 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.514 -178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.89 HG21 HD12 ' C' ' 686' ' ' ILE . 22.4 mm -63.8 -41.06 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.842 -178.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 687' ' ' ILE . . . . . 0.546 ' H ' HD12 ' B' ' 687' ' ' ILE . 3.6 mp -58.82 -42.16 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 688' ' ' ILE . . . . . 0.604 ' H ' HD12 ' B' ' 688' ' ' ILE . 4.0 mp -62.82 -43.11 98.59 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.46 ' O ' HG12 ' B' ' 689' ' ' VAL . 97.0 t -68.55 -1.93 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.181 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.099 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -89.79 -61.47 1.36 Allowed Glycine 0 C--N 1.349 1.296 0 N-CA-C 110.619 -0.993 . . . . 0.0 110.619 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 2.9 m -53.22 -20.81 4.43 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.127 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.434 HD23 HG21 ' A' ' 693' ' ' ILE . 1.0 OUTLIER -55.21 -32.58 62.37 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 121.247 -0.181 . . . . 0.0 110.841 -179.694 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.437 HG21 ' HB ' ' C' ' 693' ' ' ILE . 2.4 pp -68.5 -38.3 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.075 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 694' ' ' GLY . . . . . 0.691 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -65.58 -45.07 91.45 Favored Glycine 0 C--O 1.213 -1.195 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.706 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.87 -39.35 74.17 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -50.55 -31.41 15.61 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.691 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.9 tp -59.69 -41.58 85.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 C-N-CA 119.776 -0.77 . . . . 0.0 111.619 -177.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.406 ' O ' HG22 ' B' ' 701' ' ' VAL . 84.1 t -58.99 -28.31 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 121.289 -0.164 . . . . 0.0 111.019 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -24.87 36.62 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.22 -35.08 16.42 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 119.173 -0.441 . . . . 0.0 112.154 -177.469 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 701' ' ' VAL . . . . . 0.406 HG22 ' O ' ' B' ' 698' ' ' VAL . 34.8 m -59.24 -36.04 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.029 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.9 tt -68.52 -40.18 80.88 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 31.1 p -59.73 -31.94 70.08 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.711 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 704' ' ' LEU . . . . . 0.458 ' O ' HD13 ' B' ' 704' ' ' LEU . 0.2 OUTLIER -61.01 -25.59 67.01 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 120.662 -0.415 . . . . 0.0 109.973 179.294 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 59.1 t -90.22 -10.75 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.952 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -65.32 -10.74 35.24 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -73.98 -39.23 63.82 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 119.817 -0.753 . . . . 0.0 110.82 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.466 ' O ' HG12 ' B' ' 708' ' ' VAL . 29.9 t -91.3 -4.42 10.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.342 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 75.8 ttt-85 -57.47 132.97 54.75 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.46 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.888 -179.964 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 119.444 -0.313 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.727 HD12 ' CG ' ' B' ' 666' ' ' TRP . 0.5 OUTLIER -67.84 -84.84 0.02 OUTLIER 'General case' 0 C--N 1.348 0.543 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.54 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 662' ' ' GLU . . . . . 0.425 ' HG3' HD22 ' C' ' 661' ' ' LEU . 0.0 OUTLIER -175.68 72.45 0.02 OUTLIER 'General case' 0 C--N 1.354 0.773 0 CA-C-N 118.805 0.729 . . . . 0.0 112.283 -179.669 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.774 HD22 ' O ' ' C' ' 663' ' ' LEU . 0.0 OUTLIER -65.29 -40.07 93.35 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.057 179.077 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 664' ' ' ASP . . . . . 0.763 ' N ' HD13 ' C' ' 663' ' ' LEU . 22.5 t0 -74.37 -29.74 61.68 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -70.57 -29.36 65.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.452 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 37.5 m95 -58.52 -49.61 76.75 Favored 'General case' 0 C--O 1.22 -0.447 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.39 90.86 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.527 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 6.0 m -62.34 -31.02 71.6 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.661 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 669' ' ' LEU . . . . . 0.472 ' HG ' HG23 ' C' ' 675' ' ' ILE . 9.7 tp -55.36 -16.64 3.74 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.379 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 26.2 m95 -68.66 -15.44 63.52 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.291 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -62.59 -42.75 99.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.149 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.4 m95 -79.93 -22.38 42.77 Favored 'General case' 0 CA--C 1.552 1.048 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 15.5 t80 70.22 -51.94 0.65 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.982 1.265 . . . . 0.0 112.711 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -52.44 63.0 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.42 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.472 HG23 ' HG ' ' C' ' 669' ' ' LEU . 6.4 tp -68.44 -30.97 49.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.393 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 94.4 m -63.41 -50.28 70.43 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.844 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -68.6 -44.16 74.9 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 123.354 0.409 . . . . 0.0 110.951 -179.22 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.425 ' CE3' HD12 ' C' ' 675' ' ' ILE . 10.2 t90 -61.39 -43.56 98.66 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.937 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.577 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.3 OUTLIER -78.92 -33.18 45.72 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.215 -179.22 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 21.9 t90 -59.61 -37.43 78.57 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.97 -178.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 681' ' ' TYR . . . . . 0.767 ' HB2' HD12 ' C' ' 684' ' ' ILE . 2.3 p90 -123.93 29.93 6.32 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 119.973 -0.691 . . . . 0.0 112.334 -178.649 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.407 HD13 ' NE1' ' C' ' 678' ' ' TRP . 7.1 tp -55.77 -37.03 45.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.66 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.859 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.0 -34.66 78.5 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.239 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.767 HD12 ' HB2' ' C' ' 681' ' ' TYR . 95.0 mt -62.5 -46.22 96.92 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.556 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.623 ' HA ' HD12 ' C' ' 688' ' ' ILE . 2.3 m-85 -57.99 -29.54 65.34 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.381 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.89 HD12 HG21 ' B' ' 686' ' ' ILE . 21.8 mm -64.01 -44.1 97.76 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.985 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.9 mt -58.96 -41.41 83.03 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.623 HD12 ' HA ' ' C' ' 685' ' ' PHE . 73.9 mt -56.58 -41.53 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 58.7 t -67.63 -31.5 52.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.042 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.19 -38.67 87.47 Favored Glycine 0 C--N 1.353 1.518 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 178.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 10.7 m -78.28 -24.33 46.83 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 117.139 0.47 . . . . 0.0 111.183 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.48 -43.58 96.87 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.217 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.645 HD11 ' HG2' ' A' ' 696' ' ' ARG . 0.6 OUTLIER -61.96 -38.21 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.156 179.768 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.73 -36.4 89.63 Favored Glycine 0 CA--C 1.544 1.884 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.315 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.487 HD23 ' O ' ' C' ' 695' ' ' LEU . 1.7 tt -55.99 -31.16 62.78 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 117.049 0.425 . . . . 0.0 111.87 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -49.98 -34.76 22.01 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 9.0 tp -58.24 -40.88 79.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.2 p -56.12 -28.93 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 119.551 1.068 . . . . 0.0 110.992 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.58 -35.08 79.77 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.634 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.09 -35.78 64.96 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.522 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 69.9 t -60.0 -31.95 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.118 178.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.87 -30.69 67.93 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.867 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 15.4 m -58.24 -40.49 81.9 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.246 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 16.3 tp -55.95 -26.8 49.63 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.622 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 20.4 t -81.59 -24.65 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.372 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -60.57 -20.83 61.63 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.05 -42.66 59.88 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 120.742 0.305 . . . . 0.0 110.558 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 708' ' ' VAL . . . . . 0.501 ' O ' HG12 ' C' ' 708' ' ' VAL . 20.4 t -97.32 2.23 10.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.372 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? . . . . . 0 C--O 1.219 -0.529 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.628 179.999 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 2.2 mm? . . . . . 0 N--CA 1.489 1.506 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.836 HD13 ' NE1' ' C' ' 666' ' ' TRP . 7.2 tt 55.4 104.23 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.954 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -139.97 161.38 37.74 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.39 179.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.833 HD13 ' H ' ' A' ' 664' ' ' ASP . 0.0 OUTLIER -62.26 -37.76 86.68 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.128 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 664' ' ' ASP . . . . . 0.833 ' H ' HD13 ' A' ' 663' ' ' LEU . 37.3 m-20 -74.84 -26.47 59.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.595 178.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.07 -46.07 85.94 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -65.17 -48.27 74.08 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.052 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.32 -28.67 59.65 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.756 -179.106 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.3 t -62.15 -31.91 72.45 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.165 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.9 mp -72.28 -14.26 61.71 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -68.61 -25.07 64.67 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.608 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 37.9 t-20 -62.55 -36.42 82.58 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.5 m95 -83.36 -22.89 32.69 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.334 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 67.89 -40.13 0.41 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -62.04 -52.34 64.32 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.475 HD12 ' CE3' ' A' ' 678' ' ' TRP . 7.1 tp -68.16 -38.47 79.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 119.872 -0.731 . . . . 0.0 111.048 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -61.87 -44.43 96.84 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 119.933 -0.707 . . . . 0.0 109.579 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -65.52 -37.68 87.45 Favored 'General case' 0 C--O 1.214 -0.787 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.207 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.475 ' CE3' HD12 ' A' ' 675' ' ' ILE . 7.5 t90 -70.72 -34.5 71.98 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.47 HD23 HG13 ' A' ' 675' ' ' ILE . 1.4 mm? -67.64 -3.42 8.96 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 120.468 -0.493 . . . . 0.0 111.456 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.98 150.69 49.35 Favored 'General case' 0 C--O 1.211 -0.966 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.23 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 84.08 -23.0 0.19 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.453 0.701 . . . . 0.0 110.473 -178.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.471 HD13 ' HD1' ' A' ' 678' ' ' TRP . 1.4 tp -67.62 -42.93 87.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 21.2 ttp-105 -60.59 -48.07 83.38 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.468 ' HA ' HD12 ' A' ' 687' ' ' ILE . 1.5 mp -59.83 -38.03 74.36 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.13 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.425 ' HA ' HD12 ' A' ' 688' ' ' ILE . 9.0 t80 -52.7 -43.28 65.51 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.527 -178.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.406 ' N ' HD12 ' A' ' 686' ' ' ILE . 1.8 mp -58.29 -37.89 65.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.9 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 687' ' ' ILE . . . . . 0.468 HD12 ' HA ' ' A' ' 684' ' ' ILE . 81.2 mt -58.17 -43.8 86.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.191 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 688' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 685' ' ' PHE . 61.2 mt -58.32 -41.43 81.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 177.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.466 ' O ' HG12 ' A' ' 689' ' ' VAL . 43.5 t -67.74 -3.09 2.06 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.348 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -86.29 -53.83 2.86 Favored Glycine 0 C--N 1.349 1.277 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 178.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 15.9 m -61.36 -20.62 63.21 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.735 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.7 tp -54.04 -46.91 72.03 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.593 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.418 HG21 ' HB ' ' B' ' 693' ' ' ILE . 2.1 pp -55.97 -41.21 66.89 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.867 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.84 -51.62 52.11 Favored Glycine 0 C--O 1.214 -1.098 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.572 ' O ' HG12 ' A' ' 698' ' ' VAL . 1.2 tt -60.08 -34.23 73.16 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.993 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.519 ' NE ' HD13 ' C' ' 697' ' ' ILE . 37.9 mmt180 -65.35 -36.41 83.94 Favored 'General case' 0 C--O 1.214 -0.786 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -178.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 4.9 pt -58.98 -40.41 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 CA-C-N 119.708 1.14 . . . . 0.0 112.352 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.824 ' O ' HG22 ' A' ' 701' ' ' VAL . 5.2 p -55.59 -26.79 20.32 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.915 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.33 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -54.27 -33.88 59.62 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.28 -35.53 62.67 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 119.042 -0.504 . . . . 0.0 111.968 -176.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.824 HG22 ' O ' ' A' ' 698' ' ' VAL . 32.9 m -61.09 -31.92 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.481 178.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -24.39 63.93 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.551 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 33.9 m -57.45 -43.11 83.66 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.919 -178.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.2 tp -70.24 -36.45 74.49 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.122 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 56.9 t -60.68 -35.7 65.74 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.568 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -60.94 -21.29 63.28 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.662 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.42 ' HD3' HD21 ' C' ' 704' ' ' LEU . 45.1 mtp85 -101.92 -22.5 14.31 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.435 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.522 HG12 ' O ' ' A' ' 708' ' ' VAL . 17.0 t -108.67 26.15 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.552 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.42 -23.85 52.01 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.474 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.706 -179.917 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.529 HD12 HD23 ' A' ' 663' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.234 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 65.6 mt -137.47 124.3 21.25 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.498 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -151.26 176.51 11.15 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.581 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.604 ' C ' HD22 ' B' ' 663' ' ' LEU . 0.0 OUTLIER -52.19 -18.19 1.4 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.945 179.846 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 664' ' ' ASP . . . . . 0.458 ' N ' HD22 ' B' ' 663' ' ' LEU . 2.2 m-20 -74.51 -47.97 29.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.243 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -70.24 -38.59 75.21 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.101 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 71.8 m95 -64.96 -37.12 86.61 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.015 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.86 -46.0 88.81 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.171 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 1.9 t -59.76 -31.75 69.94 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.068 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.37 -26.36 52.67 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.174 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 670' ' ' TRP . . . . . 0.49 ' CE3' HG21 ' B' ' 676' ' ' THR . 98.2 m95 -68.77 -2.86 10.35 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 119.592 -0.843 . . . . 0.0 112.007 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -75.71 -19.09 59.34 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.619 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 5.5 m95 -102.98 -23.2 13.72 Favored 'General case' 0 C--O 1.211 -0.935 0 C-N-CA 120.166 -0.614 . . . . 0.0 111.557 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 64.07 -59.13 0.2 Allowed 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -51.0 -52.39 43.37 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.535 HD12 ' CE3' ' B' ' 678' ' ' TRP . 6.5 tp -68.21 -35.52 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 120.308 -0.557 . . . . 0.0 111.237 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 676' ' ' THR . . . . . 0.49 HG21 ' CE3' ' B' ' 670' ' ' TRP . 15.2 m -62.3 -44.75 95.79 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.319 -0.552 . . . . 0.0 110.689 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -66.3 -46.94 75.22 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.535 ' CE3' HD12 ' B' ' 675' ' ' ILE . 1.1 t90 -64.47 -38.68 91.87 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.534 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 8.3 tp -74.27 -20.19 60.23 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -109.4 9.22 25.62 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 120.573 -0.451 . . . . 0.0 112.006 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -123.53 0.5 8.81 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.065 178.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.5 HG12 HD11 ' B' ' 686' ' ' ILE . 11.3 tt -68.24 -37.78 78.57 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 CA-C-N 116.819 -0.173 . . . . 0.0 111.31 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -56.16 -46.62 79.23 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.489 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 78.2 mt -68.07 -38.12 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.332 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.482 ' HA ' HD12 ' B' ' 688' ' ' ILE . 60.3 t80 -64.78 -40.63 95.58 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.971 -179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.5 HD11 HG12 ' B' ' 682' ' ' ILE . 48.2 mt -61.84 -42.29 94.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.934 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.6 mt -59.49 -41.76 85.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.479 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 688' ' ' ILE . . . . . 0.482 HD12 ' HA ' ' B' ' 685' ' ' PHE . 79.0 mt -56.69 -41.24 74.01 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 28.1 t -67.35 -28.81 43.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 120.222 -0.591 . . . . 0.0 111.706 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.38 -26.32 43.96 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 119.946 -1.121 . . . . 0.0 110.832 178.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 16.7 m -88.1 -30.21 20.03 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 116.783 0.292 . . . . 0.0 111.351 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.72 -32.56 52.45 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 120.635 0.255 . . . . 0.0 110.618 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.667 ' O ' HD12 ' B' ' 693' ' ' ILE . 0.6 OUTLIER -76.0 -27.73 18.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.892 -179.674 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.76 -55.71 20.89 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 119.383 -1.389 . . . . 0.0 113.743 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.639 HD22 ' N ' ' B' ' 696' ' ' ARG . 0.0 OUTLIER -62.62 -29.89 70.95 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 118.138 0.969 . . . . 0.0 113.314 -178.941 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.639 ' N ' HD22 ' B' ' 695' ' ' LEU . 14.4 mmt180 -49.38 -30.4 7.74 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.725 HD13 ' NH1' ' C' ' 696' ' ' ARG . 43.3 pt -58.35 -38.77 71.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 118.102 0.41 . . . . 0.0 110.796 -178.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.49 HG12 ' O ' ' B' ' 695' ' ' LEU . 3.9 p -54.53 -27.46 17.72 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.37 -177.081 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -54.9 -26.65 37.27 Favored 'General case' 0 C--O 1.214 -0.77 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.796 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -52.67 -35.64 55.55 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 53.3 t -59.65 -31.34 46.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.54 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 34.1 tp -58.22 -33.89 69.82 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.505 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 7.9 m -58.24 -31.8 67.73 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 704' ' ' LEU . . . . . 0.516 ' N ' HD12 ' B' ' 704' ' ' LEU . 6.4 mp -77.63 -43.15 32.38 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 33.5 m -93.0 -10.66 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -178.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -60.74 -34.11 73.93 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.439 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.23 -0.73 52.77 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 61.3 t -84.1 -36.05 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 120.594 -0.443 . . . . 0.0 110.062 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -164.95 23.01 0.06 Allowed 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.44 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 118.305 -0.855 . . . . 0.0 112.394 179.86 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.511 HD23 ' N ' ' C' ' 660' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.56 HD23 ' CG ' ' C' ' 665' ' ' LYS . 0.2 OUTLIER -169.25 -38.94 0.02 OUTLIER 'General case' 0 C--O 1.21 -0.975 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.942 -178.791 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 662' ' ' GLU . . . . . 0.482 ' HG2' ' H ' ' C' ' 665' ' ' LYS . 0.8 OUTLIER 94.38 148.48 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.976 0.91 . . . . 0.0 109.476 -179.282 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 9.3 tt -52.34 -40.35 61.82 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -176.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -67.05 -39.58 86.93 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.353 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 665' ' ' LYS . . . . . 0.56 ' CG ' HD23 ' C' ' 661' ' ' LEU . 1.8 tptt -70.68 -43.5 68.95 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.03 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 666' ' ' TRP . . . . . 0.836 ' NE1' HD13 ' A' ' 661' ' ' LEU . 64.6 m95 -58.85 -48.46 81.28 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.06 -47.32 85.19 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.458 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 2.5 m -61.54 -31.83 71.87 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.337 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 8.8 tp -56.0 -11.51 1.1 Allowed 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -68.68 -18.86 64.34 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -63.87 -44.8 91.99 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 672' ' ' TRP . . . . . 0.487 ' HB2' HG22 ' C' ' 675' ' ' ILE . 14.1 m95 -79.96 -22.79 42.21 Favored 'General case' 0 CA--C 1.553 1.062 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 65.89 -68.93 0.12 Allowed 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 119.976 1.262 . . . . 0.0 112.435 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -52.15 -51.88 55.21 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.541 HG13 HD23 ' C' ' 679' ' ' LEU . 8.8 tp -67.24 -28.96 44.29 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.961 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 22.4 m -58.94 -48.6 80.91 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.976 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -68.8 -43.94 74.61 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.476 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.49 ' O ' HG23 ' C' ' 682' ' ' ILE . 19.9 t90 -63.49 -19.65 64.93 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 679' ' ' LEU . . . . . 0.541 HD23 HG13 ' C' ' 675' ' ' ILE . 1.2 mm? -88.97 -2.62 58.67 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.448 -179.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -134.75 -41.33 0.77 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 120.291 -0.563 . . . . 0.0 111.83 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -62.59 -18.1 61.46 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.49 HG23 ' O ' ' C' ' 678' ' ' TRP . 0.2 OUTLIER -56.11 -36.81 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 119.447 -0.901 . . . . 0.0 110.268 179.782 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -62.82 -40.2 96.65 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 38.1 mm -61.68 -46.91 95.53 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.561 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -67.45 -28.46 67.9 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.409 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.36 -43.58 86.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 21.7 mm -67.33 -42.08 87.17 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 C-N-CA 120.324 -0.551 . . . . 0.0 109.665 179.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 95.9 mt -60.69 -41.32 87.82 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.69 -178.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.605 ' O ' HD12 ' C' ' 692' ' ' LEU . 17.2 m -67.45 -10.95 13.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 C-N-CA 119.119 -1.033 . . . . 0.0 112.934 -176.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -91.56 -8.47 63.95 Favored Glycine 0 CA--C 1.559 2.821 0 C-N-CA 120.055 -1.069 . . . . 0.0 114.424 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 75.5 m -88.81 -34.31 17.1 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.322 1.561 . . . . 0.0 112.847 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 692' ' ' LEU . . . . . 0.838 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -53.73 -31.86 49.92 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.755 -178.15 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.838 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.2 OUTLIER -64.92 -34.76 72.65 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 C-N-CA 121.435 -0.106 . . . . 0.0 111.068 -179.539 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.9 -55.38 31.22 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.611 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.488 HD23 ' C ' ' C' ' 695' ' ' LEU . 8.6 tt -60.72 -46.34 90.78 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.725 ' NH1' HD13 ' B' ' 697' ' ' ILE . 66.1 mtp85 -55.28 -35.78 65.41 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.565 HD11 HD12 ' C' ' 693' ' ' ILE . 68.2 mt -59.23 -41.59 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.497 ' O ' HG22 ' C' ' 701' ' ' VAL . 53.4 t -56.57 -28.09 26.5 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.992 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.209 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 699' ' ' PHE . . . . . 0.579 ' HA ' HD11 ' C' ' 702' ' ' LEU . 4.5 t80 -55.34 -34.94 64.67 Favored 'General case' 0 C--O 1.206 -1.232 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.99 -36.04 78.39 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -176.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 701' ' ' VAL . . . . . 0.497 HG22 ' O ' ' C' ' 698' ' ' VAL . 16.6 m -67.79 -39.68 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -176.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 702' ' ' LEU . . . . . 0.714 ' H ' HD13 ' C' ' 702' ' ' LEU . 0.0 OUTLIER -65.83 -24.12 66.83 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 118.431 -1.308 . . . . 0.0 111.617 -178.821 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' C' C ' 703' ' ' SER . . . . . 0.569 ' N ' HD22 ' C' ' 702' ' ' LEU . 57.3 m -59.19 -40.63 86.32 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 704' ' ' LEU . . . . . 0.42 HD21 ' HD3' ' A' ' 707' ' ' ARG . 15.7 tp -59.06 -27.08 65.19 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 120.295 -0.562 . . . . 0.0 109.911 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 12.3 t -74.27 -26.74 20.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.976 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -60.87 -9.43 4.13 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 5.9 mtt-85 -90.64 -23.91 20.65 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.307 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 49.9 t -91.98 -35.99 7.42 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.548 0 C-N-CA 120.921 -0.311 . . . . 0.0 110.254 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 65.2 ttp85 . . . . . 0 CA--C 1.539 0.527 0 CA-C-O 121.123 0.487 . . . . 0.0 110.607 -179.842 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' C' ' 667' ' ' ALA . 4.2 mm? . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.482 ' O ' HD12 ' C' ' 663' ' ' LEU . 1.9 mm? -122.86 146.81 47.24 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -157.97 170.16 22.95 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.14 -0.624 . . . . 0.0 111.368 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.572 HD21 ' CD2' ' B' ' 660' ' ' LEU . 4.6 tt -61.76 -40.37 94.92 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.386 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -71.27 -26.63 62.97 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.104 -179.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 33.8 mtpt -70.17 -43.87 69.93 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.567 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 666' ' ' TRP . . . . . 0.475 ' NE1' HD12 ' A' ' 661' ' ' LEU . 89.8 m95 -66.83 -47.98 70.33 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.586 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.36 -30.79 68.66 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 120.471 -0.492 . . . . 0.0 111.01 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.2 t -58.12 -32.47 68.16 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.249 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 25.0 mt -60.01 -11.92 6.89 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.596 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 16.1 m95 -67.93 -42.2 81.39 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.855 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -15.4 58.42 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.856 177.583 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 672' ' ' TRP . . . . . 0.556 ' O ' ' N ' ' A' ' 674' ' ' ASP . 93.4 m95 -103.19 16.91 25.34 Favored 'General case' 0 C--O 1.21 -0.99 0 CA-C-O 118.742 -0.647 . . . . 0.0 111.776 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -7.24 -49.91 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 115.47 1.655 . . . . 0.0 115.47 -178.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 674' ' ' ASP . . . . . 0.556 ' N ' ' O ' ' A' ' 672' ' ' TRP . 25.8 t70 -50.8 -52.34 41.96 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 119.175 -0.44 . . . . 0.0 111.459 179.565 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.518 HG22 ' HB3' ' A' ' 672' ' ' TRP . 8.5 tp -68.65 -30.74 48.29 Favored 'Isoleucine or valine' 0 C--N 1.354 0.779 0 C-N-CA 119.477 -0.889 . . . . 0.0 111.131 179.451 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.4 m -59.2 -44.49 92.25 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -60.4 -44.18 95.95 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.475 ' CE3' HD11 ' A' ' 675' ' ' ILE . 54.6 t90 -58.15 -34.86 70.75 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.153 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 53.5 mt -84.6 -2.82 57.99 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -136.29 7.81 3.13 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -179.217 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -129.52 -27.62 2.37 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 120.197 -0.601 . . . . 0.0 111.769 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.4 HG22 ' O ' ' A' ' 678' ' ' TRP . 16.6 tt -61.49 -37.73 78.47 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.149 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 34.4 ttp-105 -55.75 -48.38 75.34 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 120.292 -0.563 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.439 ' N ' HD12 ' A' ' 684' ' ' ILE . 1.8 mp -60.68 -45.93 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -52.78 -40.91 63.62 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 121.219 -0.192 . . . . 0.0 111.335 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.546 ' CG1' HG21 ' C' ' 686' ' ' ILE . 1.3 mp -58.16 -38.04 65.79 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 CA-C-O 119.24 -0.41 . . . . 0.0 110.544 -179.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.37 -43.26 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.198 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 688' ' ' ILE . . . . . 0.615 HD12 ' H ' ' A' ' 688' ' ' ILE . 4.0 mp -62.27 -41.46 91.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.614 ' O ' HD11 ' A' ' 692' ' ' LEU . 46.7 t -68.49 3.74 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 690' ' ' GLY . . . . . 0.417 ' O ' HG22 ' A' ' 693' ' ' ILE . . . -109.31 -9.86 24.83 Favored Glycine 0 CA--C 1.545 1.911 0 C-N-CA 120.911 -0.661 . . . . 0.0 111.492 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.7 m -88.17 -28.66 21.07 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 117.098 0.449 . . . . 0.0 112.051 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.614 HD11 ' O ' ' A' ' 689' ' ' VAL . 0.2 OUTLIER -53.51 -32.32 49.94 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.335 -178.299 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.592 HD11 ' HG2' ' B' ' 696' ' ' ARG . 4.8 tp -53.88 -39.56 40.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.569 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -70.57 -36.97 68.37 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 177.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.572 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.4 OUTLIER -56.65 -31.85 64.77 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.533 -0.334 . . . . 0.0 110.962 179.343 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.514 ' HG3' HD11 ' C' ' 693' ' ' ILE . 30.1 mmt180 -61.61 -35.92 79.26 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 61.1 mt -59.15 -41.38 83.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 CA-C-O 118.973 -0.537 . . . . 0.0 112.092 -176.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.648 ' O ' HG12 ' A' ' 701' ' ' VAL . 5.3 p -56.76 -29.09 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 118.865 0.757 . . . . 0.0 111.473 -179.125 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -55.68 -35.37 65.94 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.242 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.39 -35.41 65.28 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.383 -178.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 698' ' ' VAL . 1.3 p -59.6 -31.67 47.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 178.655 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 11.3 tp -58.64 -24.53 61.33 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.796 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 68.4 m -57.57 -43.24 84.4 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.396 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.45 -42.93 99.82 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.57 -34.17 66.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.19 178.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -67.27 -32.14 72.95 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.584 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -73.94 -22.2 59.75 Favored 'General case' 0 C--O 1.219 -0.506 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.556 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 59.6 t -82.97 -36.18 12.82 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.496 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.127 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -142.79 -76.34 0.26 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.374 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.607 179.725 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.572 ' CD2' HD21 ' A' ' 663' ' ' LEU . 4.3 mp . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.81 136.96 53.08 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.597 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -149.82 175.38 11.68 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 123.34 0.4 . . . . 0.0 110.797 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.462 HD23 ' N ' ' B' ' 664' ' ' ASP . 0.2 OUTLIER -64.77 -40.22 94.91 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.792 178.447 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 664' ' ' ASP . . . . . 0.462 ' N ' HD23 ' B' ' 663' ' ' LEU . 4.4 p-10 -68.97 -26.33 64.98 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.867 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 4.0 tttm -68.85 -41.45 78.44 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.318 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -72.93 -53.58 10.92 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.297 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 667' ' ' ALA . . . . . 0.518 ' HB2' HD12 ' C' ' 660' ' ' LEU . . . -56.31 -25.84 50.08 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.704 -179.194 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 53.6 p -58.62 -31.84 68.46 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.898 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.774 HD22 HG21 ' B' ' 675' ' ' ILE . 67.8 mt -71.84 -15.07 62.13 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 18.7 m95 -69.08 -2.4 10.04 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -74.36 -48.16 29.78 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.029 -0.669 . . . . 0.0 110.696 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 6.7 p90 -103.3 -22.49 13.69 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.131 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.02 2.25 0.39 Allowed 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.3 -52.97 59.76 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 118.283 0.492 . . . . 0.0 111.435 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.774 HG21 HD22 ' B' ' 669' ' ' LEU . 6.8 tp -68.21 -31.46 51.71 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.619 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.073 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.1 m -59.2 -43.21 92.24 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.449 -179.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -67.28 -38.58 85.3 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.377 -179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.787 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.9 t90 -72.15 -46.25 57.23 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.635 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 679' ' ' LEU . . . . . 0.429 HD12 HG13 ' B' ' 675' ' ' ILE . 14.6 mt -75.33 -33.14 61.1 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -84.74 10.46 11.32 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 119.947 -0.701 . . . . 0.0 112.41 -178.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -128.96 -5.55 5.03 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 120.759 -0.377 . . . . 0.0 111.98 179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.787 HG23 ' O ' ' B' ' 678' ' ' TRP . 2.2 pp -67.74 -43.14 86.66 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.713 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.519 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 19.1 mtp-105 -55.88 -47.89 76.55 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.186 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 84.3 mt -67.91 -38.48 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.389 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -55.26 -37.91 67.87 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 121.06 -0.256 . . . . 0.0 111.61 -178.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.943 HG21 HD12 ' C' ' 686' ' ' ILE . 16.2 mm -60.99 -40.81 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.034 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.87 -41.57 83.24 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 32.1 mm -57.51 -42.84 81.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.501 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 48.6 t -68.57 -8.65 10.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.554 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.51 -37.87 13.46 Favored Glycine 0 C--N 1.349 1.259 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.64 -27.59 62.23 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.825 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.13 -54.59 43.31 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.518 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.704 HD11 ' HD3' ' C' ' 696' ' ' ARG . 0.7 OUTLIER -55.57 -28.73 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.917 -179.266 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 694' ' ' GLY . . . . . 0.526 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -67.35 -50.49 44.18 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 119.46 -1.352 . . . . 0.0 111.235 -179.149 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.495 ' O ' HG12 ' B' ' 698' ' ' VAL . 2.1 mt -56.76 -31.83 65.0 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.592 ' HG2' HD11 ' A' ' 693' ' ' ILE . 0.6 OUTLIER -50.59 -30.66 13.83 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -179.249 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.526 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.1 tp -58.78 -41.04 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -176.367 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.495 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.2 p -56.13 -28.11 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-N 118.279 0.491 . . . . 0.0 111.517 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -55.25 -26.84 42.37 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.587 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.48 -36.24 66.39 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 120.402 -0.519 . . . . 0.0 109.832 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 77.9 t -64.82 -41.34 91.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 702' ' ' LEU . . . . . 0.425 HD23 ' C ' ' B' ' 702' ' ' LEU . 10.4 tt -61.13 -38.34 86.03 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.476 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 24.3 p -59.6 -32.66 70.6 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.273 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.91 -42.33 97.44 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.103 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 59.8 t -63.1 -18.99 22.64 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.954 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.41 -34.05 75.98 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.84 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -73.81 -26.59 60.7 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.546 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 47.2 t -82.85 -36.12 12.9 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.505 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.336 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 29.1 ttt85 -150.36 -67.35 0.2 Allowed 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.824 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.419 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.518 HD12 ' HB2' ' B' ' 667' ' ' ALA . 2.1 tt . . . . . 0 N--CA 1.487 1.384 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.42 -160.67 0.78 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 178.669 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.79 141.93 26.08 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 119.884 -0.726 . . . . 0.0 110.897 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.495 ' C ' HD23 ' C' ' 663' ' ' LEU . 9.7 tt -61.33 -40.17 93.22 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.924 179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -74.06 -25.7 59.98 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.868 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -67.21 -39.83 86.35 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.974 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -62.25 -50.35 72.07 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 667' ' ' ALA . . . . . 0.516 ' HB2' ' HG ' ' A' ' 660' ' ' LEU . . . -66.55 -35.62 80.68 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.299 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 59.7 p -57.73 -31.93 66.93 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.073 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 62.7 mt -60.71 -10.1 4.89 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 120.354 -0.538 . . . . 0.0 111.991 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -68.73 -13.24 62.26 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.877 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -62.82 -44.68 95.52 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.981 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -79.8 -12.8 59.75 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 119.638 -0.825 . . . . 0.0 113.146 -177.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.3 t80 69.17 -63.99 0.35 Allowed 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.734 1.152 . . . . 0.0 112.286 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -57.21 -37.56 72.39 Favored 'General case' 0 C--O 1.218 -0.588 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.508 HD12 ' CE3' ' C' ' 678' ' ' TRP . 8.5 tp -67.73 -37.2 78.19 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.885 -179.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 4.4 m -60.97 -49.52 77.12 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.272 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -70.0 -45.07 68.06 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 120.43 -0.508 . . . . 0.0 109.634 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.508 ' CE3' HD12 ' C' ' 675' ' ' ILE . 20.2 t90 -55.89 -23.21 29.94 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.297 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 48.2 mt -94.12 -25.48 17.13 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.448 -0.501 . . . . 0.0 112.148 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -109.27 11.94 25.1 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -122.26 -28.01 4.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.613 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.2 pp -61.2 -41.7 90.55 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.759 0 C-N-CA 120.466 -0.493 . . . . 0.0 111.582 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 31.7 ttp-105 -58.47 -48.29 81.24 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.429 -0.508 . . . . 0.0 111.119 -179.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 78.8 mt -67.67 -43.28 86.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.616 ' HA ' HD12 ' C' ' 688' ' ' ILE . 2.3 m-85 -52.82 -28.18 21.57 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.902 -178.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.943 HD12 HG21 ' B' ' 686' ' ' ILE . 20.8 mm -58.25 -38.05 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.041 -178.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.5 mt -61.3 -42.0 91.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.427 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' C' ' 685' ' ' PHE . 68.5 mt -63.49 -41.16 91.7 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.73 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 689' ' ' VAL . . . . . 0.612 ' O ' HD12 ' C' ' 692' ' ' LEU . 90.2 t -67.18 -26.15 35.66 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 CA-C-O 118.578 -0.725 . . . . 0.0 112.412 -176.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -83.94 2.86 87.03 Favored Glycine 0 CA--C 1.55 2.225 0 C-N-CA 119.855 -1.164 . . . . 0.0 113.046 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 67.6 m -88.98 -34.57 16.8 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.657 1.229 . . . . 0.0 112.603 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 692' ' ' LEU . . . . . 0.892 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -68.7 -31.93 71.37 Favored 'General case' 0 C--O 1.22 -0.492 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.592 -178.47 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.892 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.1 OUTLIER -63.08 -32.39 56.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.803 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.81 -41.34 99.61 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.495 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.67 ' O ' HG22 ' C' ' 698' ' ' VAL . 0.3 OUTLIER -56.41 -31.47 63.92 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 117.351 0.575 . . . . 0.0 112.389 -179.148 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.704 ' HD3' HD11 ' B' ' 693' ' ' ILE . 0.9 OUTLIER -50.71 -36.18 34.93 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -178.375 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 1.3 pt -59.4 -41.39 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 CA-C-N 119.273 0.942 . . . . 0.0 113.311 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.725 ' O ' HG12 ' C' ' 701' ' ' VAL . 5.2 m -56.41 -27.77 25.2 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.838 0 C-N-CA 119.088 -1.045 . . . . 0.0 111.541 -178.489 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -54.84 -35.43 63.97 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.838 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.67 66.45 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.952 -179.088 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 701' ' ' VAL . . . . . 0.725 HG12 ' O ' ' C' ' 698' ' ' VAL . 2.7 p -59.74 -31.48 47.31 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.961 178.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.7 tp -58.38 -26.2 62.93 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.746 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 2.3 m -58.56 -39.28 79.82 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.054 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 15.5 tp -59.55 -39.47 84.1 Favored 'General case' 0 C--O 1.218 -0.568 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 12.8 t -76.1 -16.79 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.156 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -60.63 -28.24 68.4 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 34.9 ptt85 -78.66 -24.28 45.24 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 120.612 -0.435 . . . . 0.0 111.53 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' C' C ' 708' ' ' VAL . . . . . 0.527 ' O ' HG12 ' C' ' 708' ' ' VAL . 18.6 t -100.23 26.24 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-O 120.661 0.267 . . . . 0.0 110.795 -179.368 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 . . . . . 0 N--CA 1.469 0.515 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.867 179.939 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.443 ' N ' HD11 ' C' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.702 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 45.0 mt -132.5 -73.52 0.51 Allowed 'General case' 0 C--O 1.213 -0.816 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.52 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 69.33 147.52 0.06 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.642 0.258 . . . . 0.0 111.034 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 663' ' ' LEU . . . . . 0.586 HD22 ' C ' ' A' ' 663' ' ' LEU . 0.0 OUTLIER -53.56 -17.59 2.21 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.851 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -73.86 -37.13 64.87 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.042 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -70.29 -42.37 72.15 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.391 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -60.36 -50.06 75.12 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.458 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.99 80.11 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.094 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.2 m -57.44 -32.49 66.96 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.397 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.61 -14.69 45.83 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.882 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -68.44 -8.95 45.27 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.117 -0.633 . . . . 0.0 111.576 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -62.61 -48.02 81.22 Favored 'General case' 0 C--O 1.218 -0.585 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.183 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -102.47 -23.01 13.96 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.016 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 673' ' ' PHE . . . . . 0.41 ' HE1' HD21 ' A' ' 677' ' ' ASN . 7.2 t80 51.8 6.99 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 178.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.81 -52.81 58.51 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 118.873 0.76 . . . . 0.0 111.534 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.445 ' CG2' HD12 ' A' ' 679' ' ' LEU . 41.0 mm -68.39 -42.39 84.07 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.685 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 1.4 m -62.76 -44.81 95.21 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.233 -178.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 677' ' ' ASN . . . . . 0.41 HD21 ' HE1' ' A' ' 673' ' ' PHE . 16.1 t-20 -59.95 -46.74 88.43 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.304 -179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.439 ' CZ2' HD12 ' A' ' 682' ' ' ILE . 7.8 t-105 -71.0 -46.51 62.14 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 120.628 -0.429 . . . . 0.0 112.134 -178.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.445 HD12 ' CG2' ' A' ' 675' ' ' ILE . 96.5 mt -74.79 -11.25 60.11 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -176.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -70.35 -3.47 17.53 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 118.927 -1.109 . . . . 0.0 110.884 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -149.44 12.91 0.83 Allowed 'General case' 0 C--N 1.352 0.685 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.22 178.123 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.439 HD12 ' CZ2' ' A' ' 678' ' ' TRP . 14.9 tt -55.76 -39.63 56.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 118.841 0.746 . . . . 0.0 109.265 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 -70.16 -40.3 74.82 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.495 -0.482 . . . . 0.0 109.779 178.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 31.7 mt -59.73 -42.1 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.63 -37.65 58.82 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.886 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 17.5 mm -58.45 -38.66 71.33 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 C-N-CA 120.214 -0.594 . . . . 0.0 110.344 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.5 -42.91 85.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 56.4 mt -60.63 -42.91 93.51 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.441 ' O ' HG12 ' A' ' 689' ' ' VAL . 57.7 t -68.5 -2.49 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.21 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.883 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -92.94 -34.04 7.03 Favored Glycine 0 C--N 1.352 1.417 0 N-CA-C 109.966 -1.253 . . . . 0.0 109.966 178.355 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 56.8 m -80.36 -24.87 39.52 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -58.42 -42.62 87.63 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.224 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 3.5 tp -65.3 -28.07 43.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.52 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 694' ' ' GLY . . . . . 0.604 ' O ' HG22 ' A' ' 697' ' ' ILE . . . -69.83 -51.59 23.77 Favored Glycine 0 C--O 1.212 -1.257 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 178.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.41 -31.84 64.28 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-O 120.491 0.186 . . . . 0.0 110.501 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 0.1 OUTLIER -56.61 -37.24 70.42 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.601 179.725 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 697' ' ' ILE . . . . . 0.681 HD11 ' HB3' ' B' ' 699' ' ' PHE . 7.3 tp -60.62 -41.2 87.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 119.722 -0.791 . . . . 0.0 110.406 -179.173 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.623 ' O ' HG22 ' A' ' 701' ' ' VAL . 2.2 t -56.89 -28.97 29.6 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.632 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 699' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 13.8 m-85 -58.32 -34.57 70.74 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 178.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.7 -35.72 63.91 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 698' ' ' VAL . 25.1 m -60.62 -36.77 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.766 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 6.2 tt -58.99 -30.5 68.01 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.222 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 38.5 t -58.65 -44.97 90.25 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.794 -179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.52 HD23 ' O ' ' A' ' 704' ' ' LEU . 5.3 tt -66.91 -36.07 81.43 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-O 120.927 0.394 . . . . 0.0 110.112 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 59.7 t -60.59 -26.87 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.695 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -62.59 -34.13 76.37 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 112.322 0.489 . . . . 0.0 112.322 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -80.01 -6.2 57.16 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 120.146 -0.622 . . . . 0.0 112.352 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.525 HG12 ' O ' ' A' ' 708' ' ' VAL . 17.1 t -89.28 25.98 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.508 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 -56.63 112.23 1.23 Allowed 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.441 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 . . . . . 0 C--O 1.219 -0.54 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.999 -179.821 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 4.6 mp . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 mt 54.63 97.68 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.747 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -151.82 -179.69 7.67 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.016 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.9 tt -52.88 -36.15 58.79 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.073 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.05 -37.5 69.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.622 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -46.19 65.5 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.72 -179.184 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 93.4 m95 -62.57 -38.45 90.13 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.59 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 667' ' ' ALA . . . . . 0.54 ' HB2' HD22 ' C' ' 660' ' ' LEU . . . -72.05 -31.46 66.16 Favored 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.082 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 6.9 t -57.37 -32.08 66.43 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.409 -0.516 . . . . 0.0 110.292 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.411 ' HG ' ' CH2' ' B' ' 672' ' ' TRP . 5.9 mp -61.0 -15.61 33.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.96 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 9.9 m95 -68.66 -2.97 10.33 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 118.965 -0.541 . . . . 0.0 112.405 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -89.04 -49.57 6.68 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.935 -178.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 672' ' ' TRP . . . . . 0.411 ' CH2' ' HG ' ' B' ' 669' ' ' LEU . 4.7 p-90 -104.21 -24.15 13.17 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.666 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 2.4 t80 47.5 -4.18 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.336 0 N-CA-C 116.951 2.204 . . . . 0.0 116.951 176.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 674' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' B' ' 672' ' ' TRP . 2.7 m-20 -63.73 -54.39 36.23 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 121.061 1.755 . . . . 0.0 113.053 -177.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.426 HD13 ' HA ' ' B' ' 675' ' ' ILE . 10.7 mm -69.91 -27.59 33.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.837 178.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 34.1 m -58.66 -46.81 86.36 Favored 'General case' 0 C--O 1.22 -0.478 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.7 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -65.49 -31.74 72.97 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 120.489 -0.484 . . . . 0.0 109.855 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.49 ' CZ3' HD21 ' B' ' 679' ' ' LEU . 33.8 t90 -67.38 -45.52 76.0 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.113 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 679' ' ' LEU . . . . . 0.49 HD21 ' CZ3' ' B' ' 678' ' ' TRP . 64.4 mt -81.12 -23.27 38.46 Favored 'General case' 0 C--O 1.22 -0.464 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -177.686 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 9.3 t90 -92.53 0.62 57.45 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.83 -0.748 . . . . 0.0 112.385 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -130.23 -1.12 4.56 Favored 'General case' 0 C--O 1.218 -0.603 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.572 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 6.4 tp -65.89 -44.1 92.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 C-N-CA 120.512 -0.475 . . . . 0.0 111.664 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.94 -40.03 75.65 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.283 -179.212 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 92.8 mt -68.17 -43.86 84.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.537 ' HA ' HD13 ' B' ' 688' ' ' ILE . 2.5 m-85 -54.74 -28.4 48.17 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.39 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.493 HG21 HD12 ' C' ' 686' ' ' ILE . 19.0 mm -58.65 -40.36 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.921 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.81 -41.63 83.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 688' ' ' ILE . . . . . 0.537 HD13 ' HA ' ' B' ' 685' ' ' PHE . 3.7 mp -61.94 -41.46 91.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.214 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 46.5 t -67.8 -10.13 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 120.424 -0.51 . . . . 0.0 112.025 -177.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -77.81 -39.99 23.07 Favored Glycine 0 C--N 1.346 1.112 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 24.2 m -74.07 -17.26 60.98 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.706 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -33.7 68.97 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.27 -179.071 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.548 HG12 HD13 ' C' ' 692' ' ' LEU . 2.3 pp -70.9 -39.05 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.763 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 694' ' ' GLY . . . . . 0.551 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -63.41 -42.93 98.94 Favored Glycine 0 C--O 1.217 -0.926 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.412 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.5 OUTLIER -56.26 -31.4 63.54 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 120.584 0.231 . . . . 0.0 111.088 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.511 ' HE ' HD13 ' A' ' 697' ' ' ILE . 1.0 OUTLIER -50.27 -30.48 11.9 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.795 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.551 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.2 tp -58.9 -40.75 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -175.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.412 HG12 ' O ' ' B' ' 695' ' ' LEU . 7.4 p -55.96 -28.74 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 118.912 0.778 . . . . 0.0 111.747 -178.225 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 699' ' ' PHE . . . . . 0.681 ' HB3' HD11 ' A' ' 697' ' ' ILE . 14.9 m-85 -55.52 -24.17 30.38 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -48.61 -34.63 11.98 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -177.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 33.3 m -58.66 -31.16 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.23 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 39.1 tp -58.24 -35.76 72.2 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.366 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.2 m -58.23 -31.89 67.81 Favored 'General case' 0 C--O 1.218 -0.603 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.689 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 704' ' ' LEU . . . . . 0.439 HD22 ' N ' ' B' ' 704' ' ' LEU . 3.9 mm? -68.74 -43.5 75.76 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 120.187 -0.605 . . . . 0.0 112.078 -178.597 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 34.2 m -95.45 -10.3 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -60.62 -15.34 27.21 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 119.832 -0.747 . . . . 0.0 111.662 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 707' ' ' ARG . . . . . 0.521 ' HG3' HG13 ' B' ' 708' ' ' VAL . 21.3 ptt180 -85.89 -34.39 20.99 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 120.489 -0.484 . . . . 0.0 111.189 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.521 HG13 ' HG3' ' B' ' 707' ' ' ARG . 27.8 m -91.4 26.08 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 120.858 -0.337 . . . . 0.0 111.381 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 23.7 mmt180 -50.8 146.61 5.69 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.185 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.662 -179.982 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.54 HD22 ' HB2' ' B' ' 667' ' ' ALA . 6.1 mp . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 661' ' ' LEU . . . . . 0.488 HD21 ' CZ2' ' C' ' 666' ' ' TRP . 4.6 tp 53.96 -153.62 0.28 Allowed 'General case' 0 CA--C 1.549 0.94 0 CA-C-O 118.447 -0.787 . . . . 0.0 110.193 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 122.21 168.68 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 125.861 1.664 . . . . 0.0 109.685 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.443 HD11 ' N ' ' A' ' 660' ' ' LEU . 10.2 tt -61.08 -40.07 92.31 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.751 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -72.22 -23.83 61.3 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.862 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -69.05 -41.59 77.42 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.844 -178.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 666' ' ' TRP . . . . . 0.488 ' CZ2' HD21 ' C' ' 661' ' ' LEU . 94.2 m95 -65.37 -44.08 88.74 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.317 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.09 -30.67 60.17 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.391 -178.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 92.9 p -59.91 -32.79 71.09 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.904 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 32.6 mt -66.59 -6.9 16.93 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -77.2 -17.6 58.38 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -62.77 -50.01 72.72 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 119.009 -1.077 . . . . 0.0 110.953 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 672' ' ' TRP . . . . . 0.411 ' O ' ' N ' ' C' ' 674' ' ' ASP . 7.7 p90 -96.03 -22.88 17.09 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 43.3 p90 45.45 3.21 0.0 OUTLIER 'General case' 0 C--N 1.364 1.206 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 674' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' C' ' 672' ' ' TRP . 7.2 t0 -64.24 -53.63 46.04 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 120.069 1.304 . . . . 0.0 110.463 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 8.4 tp -69.54 -29.23 40.81 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.918 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.357 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.2 m -58.63 -38.03 77.2 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 123.123 0.264 . . . . 0.0 111.393 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -59.97 -47.08 87.3 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 120.009 -0.677 . . . . 0.0 109.947 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.549 ' HD1' HG21 ' C' ' 682' ' ' ILE . 13.1 t90 -72.53 -37.08 68.41 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.238 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -2.45 6.29 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.09 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -142.57 153.31 43.42 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-O 122.083 0.944 . . . . 0.0 112.187 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 681' ' ' TYR . . . . . 0.475 ' HB2' HD12 ' C' ' 684' ' ' ILE . 5.4 p90 56.98 -3.81 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.792 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.4 pp -62.98 -34.88 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 119.572 1.078 . . . . 0.0 109.244 176.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 683' ' ' ARG . . . . . 0.792 ' N ' HD12 ' C' ' 682' ' ' ILE . 19.1 ttp-105 -54.47 -31.17 55.16 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.117 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 684' ' ' ILE . . . . . 0.475 HD12 ' HB2' ' C' ' 681' ' ' TYR . 89.5 mt -59.49 -48.08 88.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 120.516 -0.473 . . . . 0.0 109.834 179.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.418 ' HA ' HD13 ' C' ' 688' ' ' ILE . 27.9 m-85 -53.81 -27.96 32.49 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.284 -178.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.493 HD12 HG21 ' B' ' 686' ' ' ILE . 31.4 mm -57.83 -38.09 63.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.942 -177.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.3 -42.11 86.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.418 HD13 ' HA ' ' C' ' 685' ' ' PHE . 3.8 mp -67.97 -41.56 84.74 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.731 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 93.3 t -67.82 -31.09 50.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.312 -178.116 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -77.42 13.45 11.14 Favored Glycine 0 CA--C 1.543 1.81 0 CA-C-N 120.166 1.348 . . . . 0.0 112.24 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 8.9 m -88.69 -34.13 17.32 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 117.797 0.798 . . . . 0.0 111.569 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 692' ' ' LEU . . . . . 0.638 HD12 ' H ' ' C' ' 693' ' ' ILE . 0.2 OUTLIER -53.86 -32.46 53.2 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.416 -179.731 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.638 ' H ' HD12 ' C' ' 692' ' ' LEU . 0.2 OUTLIER -55.14 -37.78 44.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.584 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.28 -42.52 97.36 Favored Glycine 0 CA--C 1.537 1.419 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 177.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.689 ' O ' HG22 ' C' ' 698' ' ' VAL . 0.3 OUTLIER -56.46 -30.46 62.92 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 179.534 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -49.75 -36.0 24.26 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -177.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 3.7 pt -59.37 -41.48 84.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 CA-C-N 119.577 1.081 . . . . 0.0 113.551 -176.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.763 ' O ' HG12 ' C' ' 701' ' ' VAL . 12.3 m -56.38 -27.94 25.41 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.894 0 C-N-CA 119.209 -0.996 . . . . 0.0 111.542 -178.498 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -54.8 -34.83 63.2 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.11 -35.86 65.09 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 119.197 -0.43 . . . . 0.0 111.803 -177.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 701' ' ' VAL . . . . . 0.763 HG12 ' O ' ' C' ' 698' ' ' VAL . 9.8 p -64.39 -33.08 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.339 178.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.89 -40.48 88.89 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.521 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 16.1 m -60.51 -34.87 74.71 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.348 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 24.8 tp -58.29 -42.83 87.45 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.319 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 19.0 m -85.78 -10.8 11.34 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -61.34 -25.95 67.49 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.546 -0.461 . . . . 0.0 111.789 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -80.07 -21.36 43.48 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 120.455 -0.498 . . . . 0.0 112.252 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 29.5 m -96.12 -29.72 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.0 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.507 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.375 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.718 ' CD1' ' HB2' ' C' ' 667' ' ' ALA . 29.1 mt . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.485 HD22 ' NE1' ' C' ' 666' ' ' TRP . 5.5 mp -126.31 -142.51 0.29 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-O 118.647 -0.692 . . . . 0.0 109.841 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 662' ' ' GLU . . . . . 0.507 ' HA ' HD22 ' B' ' 661' ' ' LEU . 0.8 OUTLIER 73.38 130.94 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.429 1.013 . . . . 0.0 109.096 -178.211 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -19.2 2.35 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.065 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -63.62 -48.44 77.33 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -71.48 -44.43 64.76 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.73 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -58.5 -35.23 71.92 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.577 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -53.75 -47.36 70.73 Favored 'General case' 0 C--O 1.215 -0.756 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.8 t -53.44 -32.56 50.4 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.321 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.462 HD12 HG23 ' A' ' 675' ' ' ILE . 0.0 OUTLIER -78.43 -14.56 59.32 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.22 -179.433 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -68.46 -17.15 64.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.78 -179.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -68.03 -48.6 65.21 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.534 -178.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 4.7 p90 -103.46 -23.15 13.55 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 121.304 -0.158 . . . . 0.0 111.22 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 p90 40.58 18.32 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -63.87 -53.12 55.6 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 118.741 0.701 . . . . 0.0 110.945 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.462 HG23 HD12 ' A' ' 669' ' ' LEU . 7.2 tp -68.86 -27.93 37.71 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.912 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.093 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.0 m -58.96 -39.33 81.36 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.511 -179.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.04 -47.06 86.41 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.597 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 678' ' ' TRP . . . . . 0.594 ' O ' HG23 ' A' ' 682' ' ' ILE . 4.9 t90 -72.69 -46.25 54.75 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.9 tp -75.41 -33.26 60.95 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -176.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 13.8 t90 -89.92 4.78 48.94 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 119.691 -0.803 . . . . 0.0 112.449 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -125.06 2.54 7.97 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 120.255 -0.578 . . . . 0.0 112.349 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.594 HG23 ' O ' ' A' ' 678' ' ' TRP . 2.6 pp -55.88 -43.34 74.18 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 C-N-CA 119.884 -0.727 . . . . 0.0 110.838 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.574 ' N ' HD12 ' A' ' 682' ' ' ILE . 0.0 OUTLIER -70.46 -48.28 56.62 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 121.114 -0.235 . . . . 0.0 110.698 179.705 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 97.2 mt -60.34 -46.72 94.59 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.361 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -52.76 -28.5 22.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.621 HG13 HD12 ' B' ' 686' ' ' ILE . 27.4 mm -58.12 -42.28 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.652 -178.073 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 47.7 mt -58.28 -41.73 81.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 120.031 -0.668 . . . . 0.0 109.342 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 36.3 mm -57.18 -41.95 78.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.554 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.435 ' O ' HG12 ' A' ' 689' ' ' VAL . 59.4 t -68.13 -6.42 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.073 0 C-N-CA 120.659 -0.417 . . . . 0.0 111.339 -179.489 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -70.67 -40.86 65.61 Favored Glycine 0 C--N 1.35 1.338 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 178.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -72.23 -33.46 67.57 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.327 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.68 -47.39 85.53 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.581 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.779 HD13 ' O ' ' A' ' 693' ' ' ILE . 0.1 OUTLIER -67.68 -35.14 71.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.641 -179.341 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -66.2 -40.19 94.77 Favored Glycine 0 CA--C 1.531 1.093 0 N-CA-C 110.039 -1.225 . . . . 0.0 110.039 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.583 HD23 ' O ' ' A' ' 695' ' ' LEU . 3.1 tt -56.62 -31.82 64.68 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 115.665 -0.267 . . . . 0.0 111.486 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -50.79 -35.26 31.08 Favored 'General case' 0 C--O 1.215 -0.763 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 20.5 tt -58.49 -40.53 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -175.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.532 HG22 ' O ' ' A' ' 695' ' ' LEU . 16.0 m -55.69 -28.69 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 119.041 0.837 . . . . 0.0 111.1 -178.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -56.41 -35.93 68.35 Favored 'General case' 0 C--O 1.214 -0.811 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.836 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.55 -50.7 71.11 Favored 'General case' 0 C--O 1.219 -0.511 0 O-C-N 123.262 0.351 . . . . 0.0 111.28 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 22.7 m -68.56 -38.83 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.115 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.1 tt -66.17 -24.64 66.68 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.424 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 68.9 m -61.68 -44.57 96.69 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.757 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.8 tp -64.36 -36.1 83.03 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.065 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 87.4 t -60.79 -36.31 70.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.951 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -60.93 -18.16 55.29 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.883 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 10.2 ttm180 -73.87 -40.32 63.31 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 121.198 -0.201 . . . . 0.0 110.915 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 708' ' ' VAL . . . . . 0.512 HG12 ' O ' ' A' ' 708' ' ' VAL . 16.3 t -96.14 25.44 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.595 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 42.2 ttm-85 -65.62 123.23 19.13 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.43 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 8.6 mp0 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.629 179.808 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.467 ' N ' HD12 ' B' ' 660' ' ' LEU . 7.8 mp . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 662' ' ' GLU . 19.2 tp 59.77 153.69 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 121.623 0.725 . . . . 0.0 111.565 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 662' ' ' GLU . . . . . 0.402 ' N ' ' HG ' ' B' ' 661' ' ' LEU . 1.3 mp0 -95.62 42.47 1.09 Allowed 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.224 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 663' ' ' LEU . . . . . 0.495 HD21 ' N ' ' C' ' 660' ' ' LEU . 7.4 tt -54.6 -41.57 70.09 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.986 -179.052 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -75.07 -34.67 61.83 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.725 178.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 11.5 tmtt? -70.57 -34.56 72.33 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 123.44 0.462 . . . . 0.0 110.766 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -58.6 -54.8 43.0 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 667' ' ' ALA . . . . . 0.654 ' HB2' ' HG ' ' C' ' 660' ' ' LEU . . . -70.68 -42.96 70.02 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.666 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 37.4 t -54.57 -31.28 56.43 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.358 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.626 HD11 HG23 ' B' ' 675' ' ' ILE . 0.2 OUTLIER -55.58 -25.65 39.37 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.111 -179.27 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -68.52 -2.81 9.62 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.104 -0.638 . . . . 0.0 111.654 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -80.35 -28.7 37.99 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.795 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 672' ' ' TRP . . . . . 0.489 ' HB2' HG22 ' B' ' 675' ' ' ILE . 7.4 m95 -87.62 -23.14 24.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.521 -179.049 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 66.5 -59.85 0.34 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 178.615 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -57.44 -52.63 64.59 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -177.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.626 HG23 HD11 ' B' ' 669' ' ' LEU . 5.2 tp -68.54 -34.45 65.49 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.811 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.4 m -60.37 -37.4 80.62 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 120.036 -0.665 . . . . 0.0 110.241 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -59.95 -46.44 89.39 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.392 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.759 ' O ' HG23 ' B' ' 682' ' ' ILE . 7.0 t90 -71.64 -30.6 65.93 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.087 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.96 -7.51 58.1 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -118.25 -20.2 8.66 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 120.642 -0.423 . . . . 0.0 112.102 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -95.2 0.87 54.44 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.25 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 682' ' ' ILE . . . . . 0.759 HG23 ' O ' ' B' ' 678' ' ' TRP . 4.7 pt -56.39 -43.46 77.52 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.839 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 25.9 ttp-105 -55.68 -46.55 77.56 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.812 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.3 mp -67.39 -37.84 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 685' ' ' PHE . . . . . 0.797 ' HA ' HD12 ' B' ' 688' ' ' ILE . 2.4 t80 -55.32 -41.54 72.56 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.074 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.621 HD12 HG13 ' A' ' 686' ' ' ILE . 3.5 mm -60.95 -45.15 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.373 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 65.7 mt -58.93 -41.48 83.16 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 688' ' ' ILE . . . . . 0.797 HD12 ' HA ' ' B' ' 685' ' ' PHE . 62.2 mt -56.9 -41.87 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.473 ' O ' HG12 ' B' ' 689' ' ' VAL . 47.0 t -68.37 -2.24 1.87 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.12 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.261 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -83.77 -42.73 7.58 Favored Glycine 0 C--N 1.349 1.274 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 68.0 m -73.43 -21.8 60.37 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.932 -0.307 . . . . 0.0 111.063 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.15 -41.63 75.71 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.453 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.667 ' O ' HD12 ' B' ' 693' ' ' ILE . 0.6 OUTLIER -72.25 -32.78 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.525 -179.654 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 694' ' ' GLY . . . . . 0.551 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -67.3 -47.01 66.07 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 119.661 -1.257 . . . . 0.0 111.419 -179.152 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.407 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.4 OUTLIER -56.82 -31.77 65.04 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.732 -179.019 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.697 ' HG3' HD11 ' A' ' 693' ' ' ILE . 37.0 mmt180 -50.63 -31.11 15.12 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 697' ' ' ILE . . . . . 0.551 HG22 ' O ' ' B' ' 694' ' ' GLY . 19.0 tt -59.42 -41.1 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 N-CA-C 113.129 0.788 . . . . 0.0 113.129 -175.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 698' ' ' VAL . . . . . 0.522 ' O ' HG22 ' B' ' 701' ' ' VAL . 8.5 p -56.43 -28.72 27.09 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.787 0 CA-C-N 118.474 0.579 . . . . 0.0 111.932 -178.576 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -55.52 -25.79 39.35 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -50.12 -35.6 26.42 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 701' ' ' VAL . . . . . 0.522 HG22 ' O ' ' B' ' 698' ' ' VAL . 33.3 m -59.85 -33.38 52.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.595 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 21.2 tp -61.65 -28.06 69.11 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.314 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 17.3 m -57.98 -34.2 69.71 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 120.971 -0.292 . . . . 0.0 111.571 -179.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 14.3 tp -77.93 -42.33 33.4 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.748 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 48.8 t -66.3 -13.58 16.25 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.345 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -60.84 -34.2 74.2 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.973 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 -76.13 -35.68 59.15 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.049 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.516 ' O ' HG12 ' B' ' 708' ' ' VAL . 16.6 t -89.1 26.07 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.521 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -60.15 116.38 4.16 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.554 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.702 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 660' ' ' LEU . . . . . 0.654 ' HG ' ' HB2' ' B' ' 667' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 5.7 mt -117.39 151.55 36.8 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.013 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -174.0 -177.9 1.42 Allowed 'General case' 0 C--O 1.22 -0.493 0 O-C-N 123.306 0.379 . . . . 0.0 110.186 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.65 -40.13 86.68 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 120.873 0.368 . . . . 0.0 110.454 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.35 -28.99 66.69 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.56 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 32.9 tptt -70.11 -43.29 71.34 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.849 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 666' ' ' TRP . . . . . 0.485 ' NE1' HD22 ' A' ' 661' ' ' LEU . 88.0 m95 -73.04 -49.16 30.27 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.088 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 667' ' ' ALA . . . . . 0.718 ' HB2' ' CD1' ' A' ' 660' ' ' LEU . . . -62.18 -14.73 40.55 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.664 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 60.3 p -65.71 -31.69 72.83 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.533 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 669' ' ' LEU . . . . . 0.461 HD23 HD11 ' C' ' 675' ' ' ILE . 8.6 mp -77.51 -6.06 52.23 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -72.12 -28.55 63.34 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -62.72 -49.89 73.25 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 118.633 -1.227 . . . . 0.0 110.756 -178.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 672' ' ' TRP . . . . . 0.418 ' O ' ' N ' ' C' ' 674' ' ' ASP . 6.1 p90 -95.86 -23.35 16.95 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 51.6 p90 38.66 19.12 0.0 OUTLIER 'General case' 0 C--N 1.363 1.168 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 674' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' C' ' 672' ' ' TRP . 1.0 OUTLIER -64.19 -54.0 40.48 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.448 179.855 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 675' ' ' ILE . . . . . 0.466 ' C ' HD12 ' C' ' 675' ' ' ILE . 1.5 pp -70.15 -33.56 55.32 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 CA-C-O 121.159 0.504 . . . . 0.0 110.491 177.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 21.0 m -58.64 -33.95 70.64 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.796 -177.628 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -59.9 -47.94 83.73 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 119.481 -0.888 . . . . 0.0 109.961 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 678' ' ' TRP . . . . . 0.525 ' HD1' HD11 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -73.43 -46.05 50.86 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.121 178.728 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 2.5 tt -67.62 -33.44 74.98 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 7.5 t90 -80.12 -17.27 53.01 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.4 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -93.03 -6.43 48.27 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.519 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 682' ' ' ILE . . . . . 0.58 ' O ' HD13 ' C' ' 686' ' ' ILE . 50.2 mm -56.04 -47.6 80.06 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -58.08 -42.01 84.68 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.3 178.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 41.4 mm -61.2 -48.53 88.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.861 -178.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.691 ' HA ' HD12 ' C' ' 688' ' ' ILE . 11.7 m-85 -69.63 -28.87 66.28 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.58 HD13 ' O ' ' C' ' 682' ' ' ILE . 1.2 mp -58.25 -50.04 79.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.584 -178.437 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 40.5 mt -59.08 -41.36 83.24 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.584 0 C-N-CA 120.36 -0.536 . . . . 0.0 109.629 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' C' ' 685' ' ' PHE . 84.1 mt -56.67 -41.88 75.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.88 -31.41 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.6 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.88 -43.44 92.54 Favored Glycine 0 CA--C 1.537 1.417 0 CA-C-N 119.147 0.885 . . . . 0.0 111.66 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 11.8 m -78.59 -20.31 50.77 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 117.501 0.651 . . . . 0.0 112.122 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.5 tp -59.72 -32.95 71.01 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.096 -178.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.2 pp -65.47 -36.47 77.75 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.38 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.68 -36.84 87.91 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 120.74 -0.743 . . . . 0.0 111.489 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 7.8 tt -56.42 -32.83 65.24 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 117.481 0.64 . . . . 0.0 111.156 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.84 -36.68 38.84 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 120.371 0.129 . . . . 0.0 111.28 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 53.5 mt -59.82 -42.03 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.175 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.544 ' O ' HG12 ' C' ' 701' ' ' VAL . 39.4 t -70.91 -33.5 52.33 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.228 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 699' ' ' PHE . . . . . 0.437 ' O ' HD23 ' C' ' 702' ' ' LEU . 0.1 OUTLIER -57.9 -35.48 71.1 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.816 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.73 -35.0 65.66 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 701' ' ' VAL . . . . . 0.544 HG12 ' O ' ' C' ' 698' ' ' VAL . 7.0 p -59.15 -31.83 46.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 119.989 -0.685 . . . . 0.0 111.389 -178.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 702' ' ' LEU . . . . . 0.437 HD23 ' O ' ' C' ' 699' ' ' PHE . 1.3 pp -58.96 -25.1 63.25 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.672 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 26.1 p -57.86 -40.38 80.02 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.052 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 14.7 tp -59.02 -31.43 68.82 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 120.523 -0.471 . . . . 0.0 109.786 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.7 t -81.09 -38.14 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.976 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -61.1 -8.55 3.52 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -178.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 3.0 ppt_? -81.76 -14.67 56.15 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 45.2 t -83.0 -36.18 12.78 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.262 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 21.2 ptt-85 . . . . . 0 C--O 1.219 -0.53 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.771 -179.856 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 660' ' ' LEU . . . . . 0.498 ' C ' HD12 ' A' ' 661' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.941 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 661' ' ' LEU . . . . . 0.498 HD12 ' C ' ' A' ' 660' ' ' LEU . 10.5 mp -118.76 136.15 54.13 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.662 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -141.98 152.29 43.31 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.072 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.3 tt -61.7 -39.84 92.9 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.141 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -26.27 62.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.618 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 19.1 tptt -70.49 -46.11 64.37 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-O 120.852 0.358 . . . . 0.0 111.182 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 64.1 m95 -71.82 -47.67 51.61 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.142 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 667' ' ' ALA . . . . . 0.594 ' HB2' ' HG ' ' B' ' 660' ' ' LEU . . . -59.54 -39.3 83.51 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 120.305 -0.558 . . . . 0.0 111.608 -178.697 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 20.5 t -58.4 -32.03 68.24 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.895 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 669' ' ' LEU . . . . . 0.656 HD21 HG22 ' A' ' 675' ' ' ILE . 2.9 tm? -60.15 -25.01 65.18 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.211 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -68.43 -3.11 10.2 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.915 -0.564 . . . . 0.0 112.24 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -74.85 -50.09 18.25 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 119.128 -1.029 . . . . 0.0 112.6 -178.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 672' ' ' TRP . . . . . 0.411 ' H ' ' HD1' ' A' ' 672' ' ' TRP . 1.0 OUTLIER -104.96 -9.86 17.64 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 118.619 0.645 . . . . 0.0 111.798 177.2 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 1.5 t80 52.06 17.17 0.64 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 176.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 674' ' ' ASP . . . . . 0.406 ' HB2' ' CE3' ' A' ' 672' ' ' TRP . 35.4 t70 -63.73 -52.74 59.13 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.044 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 675' ' ' ILE . . . . . 0.656 HG22 HD21 ' A' ' 669' ' ' LEU . 0.4 OUTLIER -68.38 -34.61 66.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 119.486 -0.886 . . . . 0.0 111.699 -178.384 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 676' ' ' THR . . . . . 0.496 ' OG1' HD11 ' A' ' 669' ' ' LEU . 0.0 OUTLIER -58.95 -33.78 71.02 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.121 -179.185 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.38 -46.79 87.68 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.153 -178.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -72.9 -46.46 52.54 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 679' ' ' LEU . . . . . 0.455 HD12 HD12 ' A' ' 675' ' ' ILE . 96.2 mt -84.61 -19.74 32.51 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -174.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -83.91 13.57 4.81 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.728 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -130.7 -35.48 1.46 Allowed 'General case' 0 C--N 1.35 0.62 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 682' ' ' ILE . . . . . 0.496 ' O ' HD13 ' A' ' 682' ' ' ILE . 0.0 OUTLIER -55.57 -36.77 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.057 178.629 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -60.18 -48.78 80.29 Favored 'General case' 0 C--N 1.349 0.553 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.14 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.32 -43.32 97.94 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.5 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 685' ' ' PHE . . . . . 0.603 ' O ' HG23 ' A' ' 689' ' ' VAL . 10.1 t80 -52.74 -27.67 18.78 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 686' ' ' ILE . . . . . 0.711 ' CD1' HG21 ' C' ' 686' ' ' ILE . 38.7 mm -57.64 -51.57 68.32 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.236 -177.034 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 687' ' ' ILE . . . . . 0.491 ' H ' HD12 ' A' ' 687' ' ' ILE . 4.2 mp -61.77 -41.65 91.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.253 179.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 90.6 mt -56.54 -40.34 67.81 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.438 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 689' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 685' ' ' PHE . 57.5 t -67.12 -2.14 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 119.905 -0.718 . . . . 0.0 111.22 -177.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -73.99 -49.36 13.36 Favored Glycine 0 C--N 1.349 1.252 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 35.4 m -66.47 -22.48 66.2 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.925 178.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.79 -32.93 54.35 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.312 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 693' ' ' ILE . . . . . 0.454 HG22 HG21 ' C' ' 693' ' ' ILE . 1.3 pp -80.58 -35.62 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.238 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.2 -45.5 95.9 Favored Glycine 0 C--N 1.342 0.911 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.748 ' O ' HG22 ' A' ' 698' ' ' VAL . 1.6 tt -56.57 -42.17 78.17 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 696' ' ' ARG . . . . . 0.456 ' HE ' HD12 ' C' ' 693' ' ' ILE . 54.0 mmt-85 -50.74 -33.92 24.99 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 122.702 0.401 . . . . 0.0 112.001 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 66.9 mt -56.95 -39.98 69.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.765 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 698' ' ' VAL . . . . . 0.748 HG22 ' O ' ' A' ' 695' ' ' LEU . 17.1 m -55.48 -28.19 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 118.874 0.761 . . . . 0.0 110.787 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -57.95 -36.68 72.88 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.678 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.05 -50.44 73.72 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.931 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 701' ' ' VAL . . . . . 0.447 HG12 ' O ' ' A' ' 698' ' ' VAL . 7.6 p -67.2 -36.97 78.25 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.97 -25.75 67.07 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 1.3 m -57.97 -44.36 87.02 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 121.163 -0.215 . . . . 0.0 110.89 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 3.6 tt -73.24 -27.77 61.77 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.096 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 66.2 t -60.87 -29.47 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -60.75 -17.55 49.36 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.421 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 707' ' ' ARG . . . . . 0.44 ' CZ ' ' CZ ' ' C' ' 707' ' ' ARG . 0.0 OUTLIER -73.85 -34.72 64.63 Favored 'General case' 0 C--O 1.219 -0.521 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.799 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 22.0 t -82.82 -26.74 8.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.331 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 66.29 111.49 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 45.1 tp60 . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.414 179.875 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 660' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' A' ' 667' ' ' ALA . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 661' ' ' LEU . . . . . 0.429 ' H ' HD12 ' B' ' 661' ' ' LEU . 8.1 mp -50.47 135.53 22.25 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 121.199 -0.2 . . . . 0.0 110.775 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -157.27 164.42 37.68 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 120.547 -0.461 . . . . 0.0 111.583 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.6 tt -56.08 -40.57 73.81 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.106 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -74.28 -29.41 61.65 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.041 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 665' ' ' LYS . . . . . 0.415 ' O ' HD13 ' B' ' 669' ' ' LEU . 1.1 tmtp? -61.11 -44.29 97.57 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.332 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -69.94 -51.14 35.29 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.8 -23.52 61.58 Favored 'General case' 0 C--O 1.217 -0.633 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 10.5 m -66.11 -31.78 72.84 Favored 'General case' 0 C--O 1.218 -0.582 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.368 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 669' ' ' LEU . . . . . 0.415 HD13 ' O ' ' B' ' 665' ' ' LYS . 4.7 mp -64.74 -22.03 66.89 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.788 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 24.5 m95 -68.7 -9.04 48.01 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -89.11 -47.64 7.96 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -103.14 -12.96 16.99 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 118.496 2.776 . . . . 0.0 118.496 -174.294 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 673' ' ' PHE . . . . . 0.463 ' HB3' HG22 ' B' ' 675' ' ' ILE . 1.4 t80 -156.75 156.31 33.11 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 122.914 2.597 . . . . 0.0 117.309 -178.212 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -63.54 -29.42 70.69 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 112.583 -2.098 . . . . 0.0 112.274 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 675' ' ' ILE . . . . . 0.463 HG22 ' HB3' ' B' ' 673' ' ' PHE . 7.2 tp -55.11 -27.0 18.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.58 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -176.736 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 11.7 m -58.59 -38.95 79.02 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.67 -36.2 70.56 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.381 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 678' ' ' TRP . . . . . 0.458 ' CE3' HD11 ' B' ' 675' ' ' ILE . 34.9 t90 -55.79 -39.76 71.74 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 116.749 -0.205 . . . . 0.0 110.574 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.56 -14.99 59.97 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 680' ' ' TRP . . . . . 0.478 ' HZ3' ' HH ' ' B' ' 681' ' ' TYR . 16.8 t90 -101.84 -4.78 25.71 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -179.106 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 681' ' ' TYR . . . . . 0.478 ' HH ' ' HZ3' ' B' ' 680' ' ' TRP . 59.8 m-85 -125.7 -2.25 7.29 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 120.328 -0.549 . . . . 0.0 112.108 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 7.1 tp -68.07 -40.39 83.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.999 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -60.35 -43.77 96.16 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.874 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 78.0 mt -68.2 -41.8 84.26 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.594 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -52.98 -28.65 24.84 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.544 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 686' ' ' ILE . . . . . 0.787 HG21 HD12 ' C' ' 686' ' ' ILE . 21.6 mm -59.32 -42.78 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.539 -179.295 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.4 mt -58.3 -41.78 82.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 688' ' ' ILE . . . . . 0.51 ' N ' HD12 ' B' ' 688' ' ' ILE . 3.0 mp -62.05 -42.01 93.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 689' ' ' VAL . . . . . 0.629 ' O ' HD11 ' B' ' 692' ' ' LEU . 59.3 t -68.89 -0.99 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.324 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -104.93 7.09 44.33 Favored Glycine 0 CA--C 1.541 1.712 0 C-N-CA 120.634 -0.793 . . . . 0.0 111.902 179.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 3.2 m -88.53 -34.35 17.43 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 117.374 0.587 . . . . 0.0 111.348 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 692' ' ' LEU . . . . . 0.629 HD11 ' O ' ' B' ' 689' ' ' VAL . 0.2 OUTLIER -65.3 -32.69 74.48 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.663 -178.71 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 693' ' ' ILE . . . . . 0.822 HD11 ' HG3' ' C' ' 696' ' ' ARG . 0.8 OUTLIER -57.26 -46.16 85.01 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.37 -178.912 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -71.2 -41.66 59.38 Favored Glycine 0 CA--C 1.532 1.111 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 178.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 695' ' ' LEU . . . . . 0.428 ' C ' HD23 ' B' ' 695' ' ' LEU . 10.5 tt -56.58 -34.9 67.61 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.595 -0.302 . . . . 0.0 111.438 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 696' ' ' ARG . . . . . 0.43 HH11 HD13 ' B' ' 693' ' ' ILE . 11.7 mtm105 -50.69 -31.59 16.86 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 42.3 mm -59.62 -41.34 84.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.33 -28.66 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -56.03 -29.21 60.07 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 120.214 -0.594 . . . . 0.0 111.678 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -51.43 -35.92 41.54 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.776 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 79.7 t -60.43 -32.3 50.84 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.851 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.28 -25.82 67.81 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.257 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 23.2 t -57.44 -37.42 72.79 Favored 'General case' 0 C--O 1.22 -0.492 0 C-N-CA 121.14 -0.224 . . . . 0.0 111.24 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 26.0 tp -64.62 -31.47 72.71 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.029 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 22.0 t -88.1 -21.94 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.035 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.04 -25.78 67.16 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.754 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 68.1 mtp85 -73.7 -49.84 23.79 Favored 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 120.614 -0.434 . . . . 0.0 111.114 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 708' ' ' VAL . . . . . 0.529 ' O ' HG12 ' B' ' 708' ' ' VAL . 18.1 t -104.54 26.1 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.545 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -53.92 146.83 13.34 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.628 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.488 179.771 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 50.67 -176.0 0.02 OUTLIER 'General case' 0 C--O 1.215 -0.721 0 CA-C-O 120.615 0.245 . . . . 0.0 111.558 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -159.87 158.84 31.64 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 663' ' ' LEU . . . . . 0.489 HD21 ' HB2' ' A' ' 660' ' ' LEU . 1.7 tm? -62.65 -40.73 97.96 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.245 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -74.53 -24.24 58.94 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.982 178.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -66.84 -39.5 87.63 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.12 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -60.25 -47.97 83.73 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.233 -0.587 . . . . 0.0 110.067 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.34 -29.35 70.39 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.73 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 19.3 t -64.41 -34.18 77.59 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.162 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 6.1 mp -68.68 -4.66 16.49 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -70.77 -28.81 64.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -62.63 -49.64 74.4 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.934 -177.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 672' ' ' TRP . . . . . 0.428 ' O ' ' N ' ' C' ' 674' ' ' ASP . 2.4 p90 -92.93 -22.67 19.08 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 115.635 1.717 . . . . 0.0 115.635 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 20.4 p90 43.28 8.86 0.0 OUTLIER 'General case' 0 C--N 1.359 1.015 0 N-CA-C 115.648 1.721 . . . . 0.0 115.648 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 674' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' C' ' 672' ' ' TRP . 9.2 t70 -64.24 -53.81 43.22 Favored 'General case' 0 C--N 1.349 0.586 0 CA-C-N 120.007 1.276 . . . . 0.0 110.63 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 7.8 tp -69.76 -33.22 55.22 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.718 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.243 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 13.4 m -58.85 -41.89 88.05 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -177.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -63.22 -43.66 97.47 Favored 'General case' 0 C--O 1.213 -0.829 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.297 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 3.1 t90 -72.51 -45.88 57.28 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.62 -27.03 55.57 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -92.93 7.91 42.0 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.52 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -137.51 3.68 2.56 Favored 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 120.507 -0.477 . . . . 0.0 111.858 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 3.9 tp -64.19 -41.89 93.81 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.063 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 4.6 ptt-85 -58.25 -43.45 87.87 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.159 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 82.5 mt -68.23 -39.87 81.82 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 177.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 685' ' ' PHE . . . . . 0.539 ' HA ' HD12 ' C' ' 688' ' ' ILE . 0.4 OUTLIER -53.39 -28.86 31.74 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.07 -179.6 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 686' ' ' ILE . . . . . 0.787 HD12 HG21 ' B' ' 686' ' ' ILE . 24.0 mm -59.78 -44.29 93.6 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.518 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.843 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 54.7 mt -58.22 -41.51 81.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.539 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 688' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' C' ' 685' ' ' PHE . 31.3 mt -57.59 -41.86 80.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.253 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 31.2 t -67.96 -31.23 51.11 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 CA-C-O 119.021 -0.514 . . . . 0.0 111.736 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -67.08 -62.22 4.62 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 119.132 0.878 . . . . 0.0 111.001 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.3 m -51.63 -22.27 3.24 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 116.9 0.35 . . . . 0.0 111.405 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 tp -57.46 -32.85 67.36 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.127 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 693' ' ' ILE . . . . . 0.456 HD12 ' HE ' ' A' ' 696' ' ' ARG . 1.2 pt -73.63 -24.86 20.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.392 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.81 -55.13 30.22 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.865 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 695' ' ' LEU . . . . . 0.658 HD23 ' O ' ' C' ' 695' ' ' LEU . 2.1 tt -56.83 -31.96 65.26 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 117.044 0.422 . . . . 0.0 111.945 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 696' ' ' ARG . . . . . 0.822 ' HG3' HD11 ' B' ' 693' ' ' ILE . 6.9 mmt180 -50.57 -34.34 25.34 Favored 'General case' 0 C--O 1.212 -0.885 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 697' ' ' ILE . . . . . 0.715 ' O ' HD13 ' C' ' 697' ' ' ILE . 0.2 OUTLIER -57.66 -40.43 75.33 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 CA-C-O 118.688 -0.673 . . . . 0.0 112.427 -175.361 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 698' ' ' VAL . . . . . 0.499 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.8 p -55.92 -29.2 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 CA-C-N 119.502 1.046 . . . . 0.0 111.185 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 699' ' ' PHE . . . . . 0.417 ' HB2' ' O ' ' C' ' 696' ' ' ARG . 0.3 OUTLIER -56.71 -34.42 67.45 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.722 179.449 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.72 -35.25 63.47 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 119.294 -0.384 . . . . 0.0 111.573 -176.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.68 -32.16 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 120.001 -0.68 . . . . 0.0 109.836 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.26 -28.8 67.06 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.496 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.0 t -63.48 -38.41 91.04 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.364 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 704' ' ' LEU . . . . . 0.432 HD11 ' HE ' ' A' ' 707' ' ' ARG . 15.0 tp -54.9 -30.98 59.59 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.083 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 41.3 t -75.44 -26.44 18.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.41 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -60.65 -16.93 43.99 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 707' ' ' ARG . . . . . 0.44 ' CZ ' ' CZ ' ' A' ' 707' ' ' ARG . 6.7 ptm180 -74.94 -32.38 61.73 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.276 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 35.4 t -82.79 -30.1 8.69 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.187 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 11.5 tpt85 . . . . . 0 CA--C 1.549 0.916 0 CA-C-O 119.264 -0.398 . . . . 0.0 111.958 179.376 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.783 HD11 ' CZ2' ' A' ' 666' ' ' TRP . 12.1 tp -171.22 144.93 2.12 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.339 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -161.59 148.85 14.6 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.261 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.816 HD13 ' N ' ' A' ' 664' ' ' ASP . 0.0 OUTLIER -54.73 -19.73 6.89 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.584 179.156 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 664' ' ' ASP . . . . . 0.816 ' N ' HD13 ' A' ' 663' ' ' LEU . 9.3 t70 -75.1 -37.56 61.45 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.314 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -68.94 -39.6 79.48 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.784 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 666' ' ' TRP . . . . . 0.783 ' CZ2' HD11 ' A' ' 661' ' ' LEU . 75.4 m95 -68.24 -49.74 58.65 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.263 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.42 -40.58 77.17 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.128 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 26.1 t -60.93 -35.69 77.37 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.846 178.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.492 HD21 ' C19' ' A' ' 801' ' ' QOJ . 6.6 mt -57.58 -19.88 28.62 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.331 179.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -68.64 -2.84 9.99 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -64.24 -48.94 73.89 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.37 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.6 -23.12 13.51 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.409 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 54.37 1.71 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -63.92 -53.53 48.9 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 119.217 0.917 . . . . 0.0 111.722 -179.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.516 HD11 ' CE3' ' A' ' 678' ' ' TRP . 8.8 tp -69.28 -32.11 52.35 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.27 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 18.5 m -58.5 -39.13 79.2 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.951 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -60.35 -41.17 93.06 Favored 'General case' 0 C--O 1.211 -0.923 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.516 ' CE3' HD11 ' A' ' 675' ' ' ILE . 76.5 t90 -71.97 -22.16 61.48 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.974 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.96 -16.46 35.75 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.69 26.44 5.59 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 119.963 -0.695 . . . . 0.0 112.329 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -130.37 -41.14 1.24 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 10.6 tt -66.53 -36.97 78.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.999 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -48.38 76.78 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 36.9 mt -60.19 -37.45 73.43 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.899 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.472 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.2 OUTLIER -52.11 -28.71 18.72 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.861 -178.032 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.718 HD11 ' CG2' ' C' ' 686' ' ' ILE . 1.4 mp -58.68 -50.52 78.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.948 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 58.1 mt -58.22 -42.01 82.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.592 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 88.5 mt -58.88 -41.17 82.1 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 685' ' ' PHE . 92.3 t -67.37 -17.96 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.018 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.13 -65.04 3.54 Favored Glycine 0 C--N 1.35 1.328 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 178.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 48.7 m -54.51 -29.51 50.63 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.772 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.9 tp -55.75 -41.77 74.45 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.926 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.629 HD12 ' HG3' ' B' ' 696' ' ' ARG . 0.3 OUTLIER -71.03 -37.08 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.114 -179.255 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.73 -40.6 98.68 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 110.124 -1.191 . . . . 0.0 110.124 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.606 HD23 ' O ' ' A' ' 695' ' ' LEU . 3.2 tt -56.44 -31.66 64.15 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-O 120.655 0.265 . . . . 0.0 111.549 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 42.1 mmt-85 -50.45 -34.56 25.2 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 697' ' ' ILE . . . . . 0.511 HD12 ' N ' ' A' ' 698' ' ' VAL . 2.4 pp -57.48 -40.38 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -175.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 695' ' ' LEU . 18.9 m -55.81 -28.33 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 119.263 -0.975 . . . . 0.0 110.965 -178.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -55.65 -36.27 66.85 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.038 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.85 -47.64 79.9 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 63.1 t -66.04 -44.54 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 702' ' ' LEU . . . . . 0.547 ' O ' HG12 ' A' ' 705' ' ' VAL . 5.8 tt -62.85 -29.51 70.8 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.928 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 35.4 t -64.41 -42.66 95.96 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.9 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.482 HD11 ' HD3' ' C' ' 707' ' ' ARG . 7.6 tp -80.1 -30.03 39.11 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.072 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.547 HG12 ' O ' ' A' ' 702' ' ' LEU . 0.5 OUTLIER -60.77 -22.67 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.542 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -60.72 -24.68 65.86 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.665 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -73.7 -11.59 60.45 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.038 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 61.9 t -107.34 -36.13 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 53.6 ttm-85 -127.91 145.62 50.89 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.65 -179.836 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 N--CA 1.497 1.914 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.678 HD21 ' CD1' ' A' ' 666' ' ' TRP . 1.2 pt? -162.84 150.61 13.66 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -167.44 -175.87 3.02 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.442 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.454 HD21 HD13 ' C' ' 660' ' ' LEU . 10.6 tt -53.55 -40.14 65.3 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.501 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -74.35 -30.63 62.09 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.481 0.488 . . . . 0.0 112.044 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 5.4 tptp -70.37 -46.36 64.23 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -66.92 -39.64 87.42 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.366 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.25 -23.36 67.03 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.742 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -31.97 73.21 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.533 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 61.1 mt -77.45 -4.22 44.33 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 10.7 m0 -68.62 -5.19 18.63 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -89.11 -49.78 6.55 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 119.208 -0.997 . . . . 0.0 111.238 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 672' ' ' TRP . . . . . 0.423 ' O ' ' N ' ' B' ' 674' ' ' ASP . 1.2 p90 -104.27 -23.62 13.21 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.918 177.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 53.6 p90 34.5 25.73 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.401 1.259 . . . . 0.0 114.401 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 674' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' B' ' 672' ' ' TRP . 72.5 m-20 -63.65 -53.08 56.98 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 119.786 -0.765 . . . . 0.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tp -69.1 -31.58 50.72 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.05 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.1 m -58.8 -36.4 74.4 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.681 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -60.49 -45.9 92.06 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.595 -0.442 . . . . 0.0 109.817 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -70.83 -45.97 63.58 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.534 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 75.6 mt -67.35 -2.79 6.66 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 119.939 -0.704 . . . . 0.0 111.795 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.3 t90 -117.69 142.78 46.85 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 72.6 13.27 5.34 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -36.35 61.16 Favored 'Isoleucine or valine' 0 C--N 1.354 0.764 0 CA-C-N 119.585 1.084 . . . . 0.0 110.419 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.8 mtm105 -55.43 -43.76 75.65 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.904 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 88.2 mt -60.45 -42.75 92.28 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.753 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -55.81 -43.78 77.24 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.32 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.502 HG21 HD11 ' C' ' 686' ' ' ILE . 1.9 mp -59.75 -40.52 82.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 120.267 -0.573 . . . . 0.0 109.644 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 90.8 mt -58.77 -41.53 82.83 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.482 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 26.0 mm -58.75 -43.94 89.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 61.3 t -68.45 -9.51 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.161 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -78.08 -39.1 24.55 Favored Glycine 0 C--N 1.351 1.389 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 16.5 m -80.9 -19.83 43.49 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.802 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.82 -40.93 94.58 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.901 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.57 HD11 ' HG2' ' C' ' 696' ' ' ARG . 0.8 OUTLIER -60.19 -40.4 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.579 -179.007 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -68.3 -43.66 78.3 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 119.566 -1.302 . . . . 0.0 111.238 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.492 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.2 OUTLIER -56.92 -38.54 73.02 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 116.906 0.353 . . . . 0.0 111.481 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.629 ' HG3' HD12 ' A' ' 693' ' ' ILE . 25.4 mmt180 -50.77 -30.17 13.4 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 44.8 mm -58.24 -39.85 75.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 119.435 -0.317 . . . . 0.0 111.225 -176.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.658 ' O ' HG22 ' B' ' 701' ' ' VAL . 6.4 p -54.97 -26.95 18.33 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 C-N-CA 120.614 -0.435 . . . . 0.0 111.007 -179.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -54.29 -24.8 20.41 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.57 -34.9 18.93 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 121.337 -0.145 . . . . 0.0 111.092 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 701' ' ' VAL . . . . . 0.658 HG22 ' O ' ' B' ' 698' ' ' VAL . 35.2 m -59.33 -31.34 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.55 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 702' ' ' LEU . . . . . 0.487 HD23 ' C ' ' B' ' 702' ' ' LEU . 8.9 tt -58.24 -41.62 84.58 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.592 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 26.7 t -64.82 -37.55 87.99 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -55.28 -43.98 75.26 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -176.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 27.1 m -71.1 -10.8 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 120.022 -0.671 . . . . 0.0 112.676 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.58 -14.05 17.81 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 119.427 -0.909 . . . . 0.0 110.84 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -73.95 -24.04 59.59 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 121.281 -0.167 . . . . 0.0 111.171 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 40.2 t -85.28 -36.07 10.58 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.275 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -68.64 -176.38 0.8 Allowed 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.498 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 118.004 -0.998 . . . . 0.0 111.067 179.855 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.454 HD13 HD21 ' B' ' 663' ' ' LEU . 17.7 mt . . . . . 0 N--CA 1.494 1.757 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -85.12 121.87 28.51 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.152 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -162.42 161.43 27.24 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.382 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 8.8 tt -52.91 -40.5 63.62 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.133 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -62.98 -31.87 73.08 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 123.834 0.709 . . . . 0.0 111.616 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -69.79 -41.17 75.44 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.047 -179.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -61.92 -49.33 76.61 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.449 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.54 -31.87 72.86 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.431 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 7.6 t -67.88 -32.68 73.33 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.604 0.24 . . . . 0.0 111.184 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.545 HD11 HG22 ' C' ' 675' ' ' ILE . 11.2 tp -57.66 -15.86 8.93 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.284 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -68.7 -2.61 9.63 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 118.981 -0.533 . . . . 0.0 112.35 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -65.03 -50.39 66.45 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 119.318 -0.953 . . . . 0.0 112.995 -177.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 672' ' ' TRP . . . . . 0.411 ' CE3' ' HB2' ' C' ' 674' ' ' ASP . 12.9 p-90 -103.81 6.17 36.45 Favored 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 56.6 -29.39 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 118.943 2.942 . . . . 0.0 118.943 175.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 674' ' ' ASP . . . . . 0.411 ' HB2' ' CE3' ' C' ' 672' ' ' TRP . 0.3 OUTLIER -63.61 -54.6 33.38 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 121.519 1.963 . . . . 0.0 113.336 -175.015 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.657 HG23 HD23 ' C' ' 679' ' ' LEU . 1.6 mm -69.75 -27.77 34.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 119.119 -1.032 . . . . 0.0 110.113 177.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 18.8 m -58.55 -49.82 76.03 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -70.15 -42.79 72.08 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -178.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -69.19 -26.48 64.86 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.657 HD23 HG23 ' C' ' 675' ' ' ILE . 0.7 OUTLIER -69.69 -32.93 71.82 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -178.388 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -126.58 18.43 7.44 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 114.495 1.295 . . . . 0.0 114.495 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -125.28 0.27 7.73 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.98 177.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 7.0 tp -68.56 -36.16 73.42 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 120.599 0.237 . . . . 0.0 111.524 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.07 -37.14 66.38 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.026 -0.533 . . . . 0.0 112.125 -176.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.416 ' N ' HD12 ' C' ' 684' ' ' ILE . 1.8 mp -63.95 -48.66 85.11 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.828 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -59.22 -30.13 68.02 Favored 'General case' 0 C--O 1.218 -0.575 0 O-C-N 123.387 0.429 . . . . 0.0 111.093 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.718 ' CG2' HD11 ' A' ' 686' ' ' ILE . 1.0 OUTLIER -58.89 -46.0 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.116 -179.272 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 63.8 mt -60.17 -41.68 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.823 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.567 ' H ' HD12 ' C' ' 688' ' ' ILE . 3.5 mp -57.05 -40.89 75.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 51.2 t -66.95 -17.6 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 119.844 -0.742 . . . . 0.0 111.431 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -70.32 -62.8 3.52 Favored Glycine 0 C--N 1.351 1.384 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.05 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 4.5 m -51.85 -25.39 7.77 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 117.365 0.583 . . . . 0.0 112.01 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.4 tp -53.77 -34.3 58.62 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.001 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.455 ' C ' HD12 ' C' ' 693' ' ' ILE . 1.7 pp -79.18 -33.32 15.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.787 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.937 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.92 -48.54 85.11 Favored Glycine 0 CA--C 1.543 1.795 0 C-N-CA 120.68 -0.771 . . . . 0.0 111.691 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.549 ' C ' HD13 ' C' ' 695' ' ' LEU . 1.2 tm? -56.57 -31.84 64.62 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -178.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.57 ' HG2' HD11 ' B' ' 693' ' ' ILE . 0.4 OUTLIER -50.5 -34.19 24.17 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.78 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 20.0 tt -57.64 -41.22 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-O 118.639 -0.696 . . . . 0.0 112.681 -174.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.661 ' O ' HG22 ' C' ' 701' ' ' VAL . 5.6 p -56.49 -28.87 27.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.028 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -34.84 69.7 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.303 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.75 -34.83 63.05 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -175.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 701' ' ' VAL . . . . . 0.661 HG22 ' O ' ' C' ' 698' ' ' VAL . 35.4 m -59.15 -31.24 45.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.459 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tt -58.64 -27.89 65.15 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.834 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 19.6 m -58.43 -38.33 77.21 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.497 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 14.2 tp -59.43 -35.23 73.64 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.441 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 9.9 t -84.9 -17.87 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.289 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.24 -25.92 66.02 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 707' ' ' ARG . . . . . 0.482 ' HD3' HD11 ' A' ' 704' ' ' LEU . 34.2 mtm105 -73.85 -45.78 48.99 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.96 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 45.3 t -88.61 -12.59 10.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.254 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.79 163.98 0.05 Allowed 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.691 179.884 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . 0.492 ' C19' HD21 ' A' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . 0.435 ' C28' HD22 ' B' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . 0.441 ' C22' HD13 ' C' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.416 HD12 HD11 ' C' ' 663' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.842 0 CA-C-O 119.695 -0.193 . . . . 0.0 110.96 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.478 ' N ' HD12 ' A' ' 661' ' ' LEU . 7.6 mp 55.88 177.87 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.527 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -169.92 147.7 3.36 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.269 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.1 tt -61.65 -40.24 94.21 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.528 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -73.98 -23.95 59.54 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.491 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 15.2 tmtt? -64.88 -42.16 95.03 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 121.059 -0.257 . . . . 0.0 111.136 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 666' ' ' TRP . . . . . 0.565 ' HE1' HD22 ' B' ' 661' ' ' LEU . 91.5 m95 -69.1 -53.27 21.15 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.328 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.55 84.89 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.875 -178.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 40.4 t -58.75 -31.77 68.63 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.743 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 679' ' ' LEU . 47.7 tp -58.73 -25.68 63.19 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.306 -178.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -68.29 -5.55 19.18 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 119.045 -1.062 . . . . 0.0 111.429 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -63.1 -40.31 97.27 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.972 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 672' ' ' TRP . . . . . 0.447 ' HB2' HG22 ' A' ' 675' ' ' ILE . 6.5 m95 -83.42 -22.75 32.59 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.591 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 42.9 t80 64.99 -67.25 0.12 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -56.04 -52.73 63.2 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.584 HD13 ' O ' ' A' ' 675' ' ' ILE . 0.3 OUTLIER -68.58 -28.42 40.13 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.767 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.477 -179.951 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.0 m -58.97 -46.39 88.18 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.882 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -62.35 -47.38 84.48 Favored 'General case' 0 C--O 1.213 -0.824 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.737 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -64.88 -37.46 87.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.784 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.407 HD23 ' CD2' ' A' ' 669' ' ' LEU . 8.5 tp -67.98 -8.86 40.88 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.328 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.3 t-105 -139.3 0.86 1.94 Allowed 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -102.5 0.42 33.59 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 119.889 -0.724 . . . . 0.0 112.125 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.619 HD12 ' N ' ' A' ' 683' ' ' ARG . 2.8 pp -55.93 -36.84 45.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.628 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.283 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.619 ' N ' HD12 ' A' ' 682' ' ' ILE . 2.1 tmm_? -67.48 -48.51 66.93 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.946 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 86.3 mt -62.74 -43.67 98.87 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.921 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -52.81 -29.07 25.52 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.781 -179.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.698 HG13 HD12 ' B' ' 686' ' ' ILE . 16.9 mm -58.69 -38.97 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.923 -179.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 10.8 mt -58.01 -41.75 81.08 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 80.8 mt -56.99 -41.28 77.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 177.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 689' ' ' VAL . 43.3 t -68.04 -0.35 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.345 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -81.1 -34.92 25.42 Favored Glycine 0 C--N 1.349 1.272 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 178.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 13.3 m -75.81 -30.74 59.14 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 116.889 0.345 . . . . 0.0 111.101 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.79 -33.12 54.97 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.944 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 1.7 pp -70.58 -37.23 69.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 120.101 -0.64 . . . . 0.0 110.033 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 694' ' ' GLY . . . . . 0.679 ' O ' HG22 ' A' ' 697' ' ' ILE . . . -59.81 -43.27 98.09 Favored Glycine 0 C--O 1.214 -1.095 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.791 ' O ' HG22 ' A' ' 698' ' ' VAL . 0.2 OUTLIER -56.7 -42.19 78.7 Favored 'General case' 0 C--O 1.211 -0.953 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.553 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -50.48 -35.25 28.24 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 697' ' ' ILE . . . . . 0.694 HD13 ' O ' ' A' ' 697' ' ' ILE . 0.2 OUTLIER -58.18 -40.19 76.37 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.77 -177.093 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.791 HG22 ' O ' ' A' ' 695' ' ' LEU . 13.2 m -55.82 -28.35 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 118.384 0.538 . . . . 0.0 110.829 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -58.45 -36.54 73.84 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.651 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.9 -50.81 72.06 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.175 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 698' ' ' VAL . 11.1 p -68.83 -32.08 53.29 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.18 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.0 tp -58.77 -27.36 64.91 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.223 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 48.3 t -58.0 -45.32 87.03 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.423 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.3 -40.97 97.02 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.92 -28.39 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.435 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -60.81 -14.8 24.03 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -39.72 63.84 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.435 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.535 HG12 ' O ' ' A' ' 708' ' ' VAL . 28.5 t -105.54 10.43 9.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.532 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 66.54 -76.07 0.05 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 122.237 -0.29 . . . . 0.0 110.531 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.468 179.924 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.423 HD23 ' N ' ' B' ' 661' ' ' LEU . 1.4 tt . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.565 HD22 ' HE1' ' A' ' 666' ' ' TRP . 0.7 OUTLIER 54.13 90.61 0.03 OUTLIER 'General case' 0 C--O 1.22 -0.461 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.933 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -143.79 147.52 34.26 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.398 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.6 ' C ' HD22 ' B' ' 663' ' ' LEU . 0.0 OUTLIER -52.92 -27.4 18.57 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.463 -179.608 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 664' ' ' ASP . . . . . 0.581 ' H ' HD13 ' B' ' 663' ' ' LEU . 1.3 t70 -74.23 -40.62 62.3 Favored 'General case' 0 C--O 1.22 -0.487 0 O-C-N 123.275 0.359 . . . . 0.0 111.147 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -65.26 -46.09 81.91 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.393 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -64.92 -43.86 91.4 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 120.779 -0.369 . . . . 0.0 111.005 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 667' ' ' ALA . . . . . 0.666 ' HB2' HD23 ' C' ' 660' ' ' LEU . . . -63.28 -31.0 72.04 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.311 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 34.4 t -55.62 -31.45 62.29 Favored 'General case' 0 C--O 1.219 -0.502 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.892 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.54 HD23 HG23 ' B' ' 675' ' ' ILE . 11.2 mp -71.44 -8.77 56.01 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -74.17 -26.79 60.5 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -63.01 -43.8 97.77 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.563 -178.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.22 -23.17 13.64 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.699 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 14.6 t80 50.42 6.27 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 178.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -63.66 -53.84 45.1 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 119.578 1.081 . . . . 0.0 110.992 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.54 HG23 HD23 ' B' ' 669' ' ' LEU . 7.0 tp -69.67 -29.83 42.65 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.911 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.844 177.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 13.1 m -59.04 -41.24 87.37 Favored 'General case' 0 C--O 1.214 -0.809 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.716 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -62.64 -47.35 84.1 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.268 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.453 ' O ' HG23 ' B' ' 682' ' ' ILE . 3.0 t90 -72.47 -45.48 59.34 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.369 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 8.3 tp -74.47 -29.38 61.42 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 19.1 t90 -86.77 -14.82 41.22 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 120.152 -0.619 . . . . 0.0 112.016 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -103.94 10.81 36.11 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.238 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.453 HG23 ' O ' ' B' ' 678' ' ' TRP . 30.9 pt -62.64 -41.27 91.55 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.3 ttp-105 -63.69 -45.55 89.53 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.749 -0.381 . . . . 0.0 110.734 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.0 -40.08 82.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.526 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.7 OUTLIER -53.38 -30.93 42.32 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.473 -179.229 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.698 HD12 HG13 ' A' ' 686' ' ' ILE . 22.5 mm -59.8 -50.06 81.48 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.136 -179.443 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 73.7 mt -62.12 -42.15 93.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 79.6 mt -60.8 -42.67 93.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.657 ' O ' HD11 ' B' ' 692' ' ' LEU . 87.0 t -68.73 -1.67 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.405 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -105.84 6.71 41.02 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.624 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 38.6 m -88.7 -34.27 17.25 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 117.414 0.607 . . . . 0.0 111.583 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.657 HD11 ' O ' ' B' ' 689' ' ' VAL . 0.2 OUTLIER -61.07 -35.12 76.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.417 -178.669 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.738 ' O ' HD13 ' B' ' 693' ' ' ILE . 0.0 OUTLIER -61.48 -33.54 57.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.956 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 694' ' ' GLY . . . . . 0.641 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -73.05 -44.06 37.67 Favored Glycine 0 C--O 1.214 -1.103 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 178.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.75 -41.62 77.87 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 121.323 -0.151 . . . . 0.0 110.836 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 28.0 mmt180 -51.03 -31.3 17.93 Favored 'General case' 0 C--O 1.214 -0.773 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.678 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.2 OUTLIER -59.53 -40.68 82.57 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.26 -177.763 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 54.0 t -56.04 -28.21 24.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 119.551 -0.261 . . . . 0.0 110.889 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -55.44 -26.82 44.27 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 120.023 -0.671 . . . . 0.0 111.276 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -53.12 -36.82 61.18 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 120.639 -0.424 . . . . 0.0 109.943 178.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.57 -43.15 98.13 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.534 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.7 tt -63.33 -40.69 98.01 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.578 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.4 t -60.36 -32.75 71.57 Favored 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.287 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.86 -40.19 94.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.86 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.76 -19.5 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.684 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -60.85 -17.72 51.78 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.718 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 8.6 tpp85 -73.9 -41.43 62.13 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 46.1 t -92.21 -36.25 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.152 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 18.8 ttm105 -142.74 151.74 41.59 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.945 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.034 -0.984 . . . . 0.0 111.131 179.871 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.666 HD23 ' HB2' ' B' ' 667' ' ' ALA . 5.2 mp . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.501 HD11 ' HE1' ' C' ' 666' ' ' TRP . 0.3 OUTLIER -85.86 121.01 27.9 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.216 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 662' ' ' GLU . . . . . 0.47 ' N ' HD13 ' C' ' 661' ' ' LEU . 38.6 tt0 -161.25 162.64 31.18 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.079 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.416 HD11 HD12 ' A' ' 660' ' ' LEU . 9.3 tt -58.03 -40.03 79.84 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.538 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -74.01 -23.95 59.51 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.511 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -44.36 76.08 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.232 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 666' ' ' TRP . . . . . 0.501 ' HE1' HD11 ' C' ' 661' ' ' LEU . 86.5 m95 -62.67 -49.98 72.98 Favored 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 120.671 -0.412 . . . . 0.0 111.087 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.0 -30.56 59.7 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.509 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.8 m -61.59 -32.32 72.42 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.454 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.422 HD11 ' C21' ' C' ' 801' ' ' QOJ . 4.5 mm? -67.32 -8.83 35.42 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -68.63 -22.39 64.42 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.758 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.09 -42.65 99.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 672' ' ' TRP . . . . . 0.531 ' HB2' HG22 ' C' ' 675' ' ' ILE . 2.6 m95 -80.02 -22.75 42.06 Favored 'General case' 0 CA--C 1.558 1.269 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -176.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 63.27 -69.4 0.07 Allowed 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 120.068 1.304 . . . . 0.0 114.204 178.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -50.9 -52.37 42.55 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -176.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.531 HG22 ' HB2' ' C' ' 672' ' ' TRP . 7.3 tp -68.56 -28.49 40.44 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.006 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.6 m -58.81 -43.76 90.64 Favored 'General case' 0 C--O 1.22 -0.475 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.167 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -60.36 -47.02 87.84 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 120.326 -0.549 . . . . 0.0 109.8 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 41.8 t90 -57.55 -41.34 80.81 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.135 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 53.4 mt -73.62 -19.67 60.8 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -112.57 1.8 15.97 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -120.74 -7.9 9.53 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.542 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 8.0 tp -58.51 -36.62 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.998 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 49.3 ttp180 -55.8 -48.2 75.8 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.455 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.456 ' N ' HD12 ' C' ' 684' ' ' ILE . 2.0 mp -67.77 -46.75 81.85 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.572 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.411 ' O ' HG23 ' C' ' 689' ' ' VAL . 5.8 m-85 -52.74 -30.03 30.3 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 123.248 0.343 . . . . 0.0 111.067 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.528 HG23 HD11 ' A' ' 686' ' ' ILE . 1.0 OUTLIER -58.82 -45.79 91.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.496 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 52.7 mt -62.74 -41.65 93.21 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.453 HD12 ' N ' ' C' ' 688' ' ' ILE . 2.1 mp -56.49 -40.89 70.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.737 ' O ' HD12 ' C' ' 692' ' ' LEU . 87.2 t -66.81 -22.17 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.899 -176.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.02 -5.43 87.66 Favored Glycine 0 CA--C 1.555 2.568 0 CA-C-N 119.93 1.241 . . . . 0.0 113.34 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 67.4 m -88.76 -34.5 17.1 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.97 1.385 . . . . 0.0 113.046 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 692' ' ' LEU . . . . . 0.852 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -53.85 -31.68 50.39 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.049 -178.788 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.852 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.2 OUTLIER -62.05 -33.87 60.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 178.904 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.73 -37.14 89.3 Favored Glycine 0 CA--C 1.54 1.626 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.496 ' O ' HG23 ' C' ' 698' ' ' VAL . 4.1 tt -56.39 -30.85 63.25 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -49.42 -36.3 21.78 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.517 HD12 ' N ' ' C' ' 698' ' ' VAL . 2.2 pp -59.89 -41.92 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.964 0.802 . . . . 0.0 112.609 -177.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.717 ' O ' HG22 ' C' ' 701' ' ' VAL . 0.0 OUTLIER -61.61 -28.85 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 118.523 -1.271 . . . . 0.0 110.282 -179.293 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 699' ' ' PHE . . . . . 0.406 ' O ' HD23 ' C' ' 702' ' ' LEU . 1.0 OUTLIER -64.45 -35.54 81.26 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -179.331 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.68 -35.48 66.08 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -176.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 701' ' ' VAL . . . . . 0.717 HG22 ' O ' ' C' ' 698' ' ' VAL . 34.1 m -59.77 -31.52 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 120.063 -0.655 . . . . 0.0 111.515 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 702' ' ' LEU . . . . . 0.406 HD23 ' O ' ' C' ' 699' ' ' PHE . 1.5 pp -58.47 -28.77 65.63 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.178 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.3 m -58.04 -41.42 83.22 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.337 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 24.9 tp -62.23 -33.56 74.82 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 23.0 t -69.87 -27.25 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.609 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -60.94 -7.01 2.11 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 64.0 ttt-85 -73.81 -42.51 60.81 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 3.1 t -102.68 26.08 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.673 179.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.54 -78.4 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.694 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.463 179.801 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . 0.5 ' C18' HG21 ' A' ' 675' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . 0.422 ' C21' HD11 ' C' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 45.9 mt . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.34 -155.93 0.2 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.083 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 78.25 168.6 0.21 Allowed 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 117.961 0.346 . . . . 0.0 110.706 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 3.4 tt -52.3 -22.57 4.64 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.204 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -69.47 -45.54 68.77 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.322 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -70.4 -41.33 73.15 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.7 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 666' ' ' TRP . . . . . 0.664 ' CD1' HD13 ' B' ' 661' ' ' LEU . 77.2 m95 -64.56 -38.8 92.27 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.116 -179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.33 78.82 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 120.293 -0.563 . . . . 0.0 112.487 -178.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 11.5 t -57.39 -32.6 66.98 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.144 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.468 HD11 ' CG2' ' A' ' 675' ' ' ILE . 15.3 tp -58.76 -23.1 59.47 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.177 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -79.22 -2.99 43.62 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 118.274 -0.87 . . . . 0.0 112.954 -177.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.23 -50.68 37.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 117.987 -1.485 . . . . 0.0 111.906 -177.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -104.9 -22.13 13.2 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-O 120.714 0.292 . . . . 0.0 110.546 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 47.9 p90 40.22 23.28 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 178.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -62.81 -52.68 62.23 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.51 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.468 ' CG2' HD11 ' A' ' 669' ' ' LEU . 7.4 tp -68.59 -27.35 35.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.685 178.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 25.8 m -58.03 -36.15 72.32 Favored 'General case' 0 C--N 1.347 0.483 0 C-N-CA 120.367 -0.533 . . . . 0.0 109.719 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -59.94 -47.5 85.56 Favored 'General case' 0 C--O 1.219 -0.5 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 177.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.461 ' O ' HG22 ' A' ' 682' ' ' ILE . 76.6 t90 -61.73 -19.86 62.88 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.224 177.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.5 tp -94.03 -8.5 39.68 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 120.362 -0.535 . . . . 0.0 112.011 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -128.33 21.38 6.16 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 120.367 -0.533 . . . . 0.0 112.123 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -132.41 -40.24 1.0 Allowed 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 178.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.566 ' O ' HD13 ' A' ' 682' ' ' ILE . 0.0 OUTLIER -68.07 -38.77 80.34 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.744 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.242 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -59.28 -48.17 82.61 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.528 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -62.06 -45.61 98.35 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.61 ' HA ' HD12 ' A' ' 688' ' ' ILE . 1.0 OUTLIER -52.72 -27.56 18.15 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 179.569 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.82 HG23 HG12 ' C' ' 686' ' ' ILE . 32.7 mm -57.33 -50.52 76.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 C-N-CA 120.161 -0.616 . . . . 0.0 110.581 -177.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 44.0 mt -58.94 -42.03 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 119.614 -0.834 . . . . 0.0 109.854 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 688' ' ' ILE . . . . . 0.61 HD12 ' HA ' ' A' ' 685' ' ' PHE . 81.8 mt -56.65 -40.91 72.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.483 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 88.8 t -67.25 -16.02 20.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.864 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -72.32 -26.4 72.11 Favored Glycine 0 CA--C 1.539 1.542 0 N-CA-C 110.087 -1.205 . . . . 0.0 110.087 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -86.33 -19.84 29.22 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.671 0.236 . . . . 0.0 111.094 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.39 -40.9 88.08 Favored 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.266 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.763 HD13 ' O ' ' A' ' 693' ' ' ILE . 0.1 OUTLIER -68.53 -33.89 62.48 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.185 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -68.0 -43.22 82.92 Favored Glycine 0 C--O 1.213 -1.203 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.676 HD23 ' O ' ' A' ' 695' ' ' LEU . 4.5 tt -55.96 -31.45 62.99 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-O 121.071 0.462 . . . . 0.0 110.697 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.416 ' HG2' HD11 ' C' ' 693' ' ' ILE . 2.7 tpp180 -50.34 -35.28 27.09 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.35 -40.49 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 695' ' ' LEU . 10.8 m -55.79 -28.02 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 119.5 -0.88 . . . . 0.0 111.204 -177.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -55.28 -36.82 66.55 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.644 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.1 -48.92 77.44 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 88.4 t -65.65 -39.73 85.82 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 702' ' ' LEU . . . . . 0.407 ' HA ' HG12 ' A' ' 705' ' ' VAL . 7.2 tt -60.9 -33.1 72.6 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.701 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 21.7 t -64.29 -45.22 88.96 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.208 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 16.5 tp -81.23 -34.09 32.4 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 702' ' ' LEU . 1.8 p -60.87 -18.67 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.697 -178.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -66.26 -12.51 56.76 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 -73.78 -38.58 64.61 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.381 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 2.8 m -95.87 23.53 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.135 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 29.6 ttm180 -96.94 -59.16 1.86 Allowed 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 117.825 -1.084 . . . . 0.0 110.095 179.842 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.505 ' C ' HD12 ' B' ' 661' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.664 HD13 ' CD1' ' A' ' 666' ' ' TRP . 6.7 mp -125.64 92.33 3.58 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.217 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -140.09 160.89 38.93 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.295 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.73 -39.94 68.77 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.688 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -72.63 -32.23 65.75 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.848 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -46.2 64.62 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -72.81 -32.53 65.6 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.383 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.77 -38.12 79.83 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.676 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 26.5 t -59.63 -32.39 70.39 Favored 'General case' 0 C--O 1.218 -0.602 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.817 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 7.9 mt -57.57 -19.41 25.39 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.94 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -68.69 -2.88 10.22 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 119.909 -0.716 . . . . 0.0 112.511 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -81.39 -49.43 10.67 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.918 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.1 p90 -104.23 -23.08 13.29 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.516 177.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 49.7 p90 38.05 25.33 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 178.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -63.63 -53.59 49.02 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.606 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 5.8 tp -69.17 -41.22 81.26 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.394 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.2 m -59.01 -50.57 73.58 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.586 -178.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -65.52 -33.39 75.81 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 120.061 -0.655 . . . . 0.0 111.029 -179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.454 ' O ' HG12 ' B' ' 682' ' ' ILE . 15.1 t-105 -72.13 -47.12 53.45 Favored 'General case' 0 C--O 1.209 -1.058 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 679' ' ' LEU . . . . . 0.676 HD22 HG13 ' B' ' 682' ' ' ILE . 0.2 OUTLIER -86.43 -17.14 35.07 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -176.857 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 4.2 t90 -69.49 0.72 4.83 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.718 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -126.71 -17.19 5.06 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.676 HG13 HD22 ' B' ' 679' ' ' LEU . 49.3 mm -59.34 -46.21 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 119.113 -0.47 . . . . 0.0 112.049 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 7.4 ptt-85 -56.51 -44.04 80.35 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.222 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 86.4 mt -67.73 -42.92 86.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.604 ' HA ' HD12 ' B' ' 688' ' ' ILE . 0.3 OUTLIER -53.26 -28.18 26.31 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.989 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.701 HG21 HD11 ' C' ' 686' ' ' ILE . 29.9 mm -58.15 -49.7 80.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 C-N-CA 120.864 -0.335 . . . . 0.0 111.132 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 49.9 mt -57.57 -41.73 79.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 688' ' ' ILE . . . . . 0.604 HD12 ' HA ' ' B' ' 685' ' ' PHE . 61.3 mt -58.1 -42.06 82.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.204 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.485 ' O ' HG12 ' B' ' 689' ' ' VAL . 57.4 t -68.61 -3.04 2.29 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.17 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.013 -179.358 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.92 -36.83 10.79 Favored Glycine 0 C--N 1.346 1.096 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.54 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 71.0 m -75.09 -27.04 59.73 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 117.077 0.439 . . . . 0.0 111.045 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 mp -53.5 -32.22 49.41 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.982 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 1.6 pp -74.7 -38.17 44.35 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.712 0 C-N-CA 119.886 -0.725 . . . . 0.0 111.155 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.47 -55.24 28.57 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.584 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.709 ' C ' HD22 ' B' ' 695' ' ' LEU . 0.0 OUTLIER -56.56 -28.32 59.9 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 117.298 0.549 . . . . 0.0 111.988 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.518 ' HE ' HD11 ' A' ' 693' ' ' ILE . 0.2 OUTLIER -46.68 -28.49 1.5 Allowed 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 123.022 0.529 . . . . 0.0 112.089 -177.261 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 6.9 tp -57.33 -39.17 66.31 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.217 0 CA-C-O 118.958 -0.544 . . . . 0.0 111.553 -177.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.674 HG22 ' O ' ' B' ' 695' ' ' LEU . 28.7 m -54.88 -28.28 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-N 119.124 0.875 . . . . 0.0 111.548 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -55.21 -25.8 35.34 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -50.5 -50.16 53.63 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.503 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 701' ' ' VAL . . . . . 0.494 HG22 ' O ' ' B' ' 698' ' ' VAL . 31.0 m -68.03 -32.06 54.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.646 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.1 tt -63.46 -26.97 68.97 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.586 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 40.2 m -63.29 -34.49 77.8 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.285 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 20.0 tp -61.83 -43.19 99.34 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.109 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 81.3 t -65.45 -10.93 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.124 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -76.82 -21.65 54.76 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.633 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.46 -38.97 16.78 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 121.367 -0.133 . . . . 0.0 111.019 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.508 HG22 ' O ' ' B' ' 708' ' ' VAL . 11.4 p -88.15 25.55 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.301 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 46.7 ttt85 -60.07 138.78 57.8 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.503 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.705 -179.866 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 N--CA 1.493 1.721 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.472 HD11 ' CZ2' ' C' ' 666' ' ' TRP . 0.1 OUTLIER -48.88 134.92 16.18 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.951 -179.442 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -168.55 151.84 5.49 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.081 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.696 HD22 ' N ' ' C' ' 664' ' ' ASP . 0.0 OUTLIER -56.67 -29.18 62.06 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.264 -179.166 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 664' ' ' ASP . . . . . 0.696 ' N ' HD22 ' C' ' 663' ' ' LEU . 4.8 t70 -74.17 -27.19 60.71 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.677 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.89 -39.25 76.37 Favored 'General case' 0 C--O 1.219 -0.535 0 O-C-N 123.355 0.409 . . . . 0.0 110.812 -179.282 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 666' ' ' TRP . . . . . 0.472 ' CZ2' HD11 ' C' ' 661' ' ' LEU . 79.8 m95 -63.69 -52.16 61.84 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.4 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -51.89 -34.34 40.84 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 37.4 m -59.12 -34.41 72.01 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.944 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 10.8 mp -78.07 -9.71 59.27 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 11.7 m0 -68.66 -26.24 65.21 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.115 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -62.78 -42.61 99.78 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -79.58 -22.17 44.09 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -177.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 69.08 -44.2 0.53 Allowed 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.895 1.225 . . . . 0.0 113.063 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -57.56 -52.8 63.93 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 118.431 0.56 . . . . 0.0 111.585 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.61 -30.34 46.95 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.531 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.2 m -58.73 -45.24 90.08 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.577 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -78.42 -22.37 47.85 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.932 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -56.37 -22.12 29.15 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.143 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.27 -33.15 13.35 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.903 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 680' ' ' TRP . . . . . 0.46 ' O ' HD12 ' C' ' 684' ' ' ILE . 0.0 OUTLIER -97.89 24.37 7.0 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.632 -179.266 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -133.03 -39.4 0.95 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.559 HD13 ' C ' ' C' ' 682' ' ' ILE . 0.0 OUTLIER -61.15 -45.62 98.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.51 0 CA-C-N 116.325 -0.398 . . . . 0.0 109.99 178.498 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 30.8 ttp180 -59.29 -46.71 87.82 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 121.237 0.541 . . . . 0.0 110.257 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.46 HD12 ' O ' ' C' ' 680' ' ' TRP . 80.0 mt -67.88 -36.47 75.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.468 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.41 -28.98 14.33 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -175.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.82 HG12 HG23 ' A' ' 686' ' ' ILE . 2.2 mp -60.03 -39.98 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 119.474 -0.891 . . . . 0.0 109.059 178.35 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 46.5 mt -58.72 -41.51 82.61 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 34.3 mm -59.8 -44.15 93.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.526 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 53.6 t -68.18 -24.15 29.62 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.118 0 CA-C-O 118.924 -0.56 . . . . 0.0 112.149 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.6 -61.23 7.72 Favored Glycine 0 C--N 1.354 1.535 0 N-CA-C 110.149 -1.181 . . . . 0.0 110.149 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 45.4 m -57.33 -31.52 65.78 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.585 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -60.8 -47.17 87.54 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.676 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.693 HD13 ' O ' ' C' ' 693' ' ' ILE . 0.2 OUTLIER -73.09 -34.34 44.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 119.986 -0.685 . . . . 0.0 109.959 179.562 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.82 -43.4 96.59 Favored Glycine 0 CA--C 1.54 1.628 0 C-N-CA 120.665 -0.778 . . . . 0.0 111.335 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.779 ' O ' HD22 ' C' ' 695' ' ' LEU . 0.1 OUTLIER -56.22 -31.29 63.36 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 117.004 0.402 . . . . 0.0 110.572 -179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.406 ' N ' HD13 ' C' ' 695' ' ' LEU . 21.6 mmm180 -49.81 -34.69 20.32 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.727 ' O ' HD13 ' C' ' 697' ' ' ILE . 0.2 OUTLIER -57.89 -40.12 74.73 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -175.225 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.465 HG12 ' O ' ' C' ' 695' ' ' LEU . 8.7 p -54.9 -28.43 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.148 -177.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -60.32 -35.68 76.19 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.05 -39.08 71.48 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.817 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 86.2 t -62.49 -31.86 53.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.115 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 12.7 tp -58.69 -37.03 75.19 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.452 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 10.3 p -57.83 -35.56 71.05 Favored 'General case' 0 C--O 1.219 -0.521 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.844 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.6 tp -58.86 -37.04 75.63 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.811 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 16.3 t -76.28 -16.23 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.201 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -63.12 -28.87 70.36 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 707' ' ' ARG . . . . . 0.536 ' HG3' HG13 ' C' ' 708' ' ' VAL . 48.2 ptt85 -86.42 -37.36 18.42 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.314 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 708' ' ' VAL . . . . . 0.536 HG13 ' HG3' ' C' ' 707' ' ' ARG . 33.6 m -90.95 -1.76 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.276 0.472 . . . . 0.0 112.276 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 12.9 mmp_? 54.55 178.72 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.718 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.597 179.992 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . 0.46 ' C17' HD12 ' A' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . 0.401 ' C30' HD11 ' B' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 660' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.475 HD12 ' CD1' ' C' ' 666' ' ' TRP . 34.0 mt -74.78 177.92 5.85 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -169.75 168.94 8.73 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.417 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.434 HD11 ' N ' ' B' ' 660' ' ' LEU . 8.9 tt -61.59 -40.14 93.72 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.671 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.19 -24.43 62.23 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.738 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -66.54 -46.03 77.48 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.244 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -73.19 -51.96 15.89 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.21 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 667' ' ' ALA . . . . . 0.478 ' HB2' HD22 ' B' ' 660' ' ' LEU . . . -58.38 -22.63 54.49 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.772 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 13.6 t -60.41 -32.58 71.48 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.298 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 669' ' ' LEU . 3.3 mm? -71.4 -14.22 62.1 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.41 -0.516 . . . . 0.0 112.061 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -68.97 -12.69 61.9 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.95 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -62.65 -48.23 80.22 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.231 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.71 -22.61 15.32 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.094 179.409 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 9.7 t80 59.02 -0.34 0.14 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -63.53 -53.03 58.26 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 118.894 0.77 . . . . 0.0 110.867 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.52 HD13 ' O ' ' A' ' 675' ' ' ILE . 0.3 OUTLIER -69.05 -31.61 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.826 179.159 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.3 m -58.69 -44.95 90.44 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.76 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -60.64 -41.55 95.16 Favored 'General case' 0 C--O 1.215 -0.721 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.589 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 11.1 t90 -71.17 -27.66 63.69 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.375 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.5 -15.15 31.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -111.13 -5.26 14.78 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -118.42 -11.11 10.03 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.569 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 15.3 tt -66.83 -38.91 82.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.748 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -56.48 -48.33 77.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 120.056 -0.657 . . . . 0.0 109.436 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 82.0 mt -63.7 -46.88 93.45 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -29.09 24.43 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.427 HG23 HG12 ' B' ' 686' ' ' ILE . 1.0 OUTLIER -58.36 -43.34 86.16 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.191 -179.082 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 46.7 mt -58.68 -41.45 82.35 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.259 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 42.5 mm -56.28 -41.31 70.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 689' ' ' VAL . 46.3 t -68.09 -0.27 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 120.531 -0.467 . . . . 0.0 111.411 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -99.24 -31.94 5.99 Favored Glycine 0 CA--C 1.535 1.329 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.1 m -73.72 -16.86 61.18 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.853 0.327 . . . . 0.0 111.232 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.0 -40.14 80.02 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.224 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.703 HD13 ' O ' ' A' ' 693' ' ' ILE . 0.2 OUTLIER -70.61 -35.42 61.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.368 179.668 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.67 -47.78 83.51 Favored Glycine 0 C--N 1.347 1.159 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.632 HD23 ' O ' ' A' ' 695' ' ' LEU . 4.6 tt -56.13 -31.68 63.55 Favored 'General case' 0 C--O 1.21 -1.013 0 CA-C-O 121.032 0.444 . . . . 0.0 110.793 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -50.52 -34.82 26.77 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.5 tp -58.04 -40.07 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -175.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.576 HG22 ' O ' ' A' ' 695' ' ' LEU . 17.4 m -55.27 -28.04 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 118.807 0.73 . . . . 0.0 110.696 -178.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -55.76 -36.38 67.26 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.43 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.66 -50.51 73.58 Favored 'General case' 0 C--O 1.219 -0.536 0 O-C-N 123.291 0.369 . . . . 0.0 111.064 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 698' ' ' VAL . 9.0 p -68.16 -33.99 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 120.491 -0.484 . . . . 0.0 109.939 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 702' ' ' LEU . . . . . 0.79 ' O ' HG12 ' A' ' 705' ' ' VAL . 0.3 OUTLIER -66.58 -36.99 83.99 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 178.814 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 703' ' ' SER . . . . . 0.448 ' N ' HD23 ' A' ' 702' ' ' LEU . 66.8 m -64.4 -43.93 92.9 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.394 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 11.4 tp -81.01 -17.46 50.23 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.79 HG12 ' O ' ' A' ' 702' ' ' LEU . 2.5 p -60.89 -29.24 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.226 -178.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -61.91 -11.12 11.48 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 52.5 ttt85 -73.68 -35.3 65.18 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 121.112 -0.235 . . . . 0.0 110.795 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 47.3 t -102.44 -36.19 4.33 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.531 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.18 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -162.39 154.7 19.14 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.899 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.105 -0.95 . . . . 0.0 110.83 179.972 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 667' ' ' ALA . 12.5 tp . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 55.0 mt -135.93 149.49 48.95 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.358 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -178.6 174.47 1.2 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.61 HD12 ' N ' ' B' ' 664' ' ' ASP . 0.3 OUTLIER -58.3 -15.07 8.86 Favored 'General case' 0 C--O 1.211 -0.967 0 C-N-CA 119.041 -1.063 . . . . 0.0 111.06 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 664' ' ' ASP . . . . . 0.61 ' N ' HD12 ' B' ' 663' ' ' LEU . 4.0 p-10 -66.25 -39.72 89.68 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -70.67 -46.42 63.22 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.743 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 666' ' ' TRP . . . . . 0.515 ' CD1' HD12 ' C' ' 661' ' ' LEU . 77.0 m95 -73.19 -30.64 63.69 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -81.52 -10.74 59.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.542 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 5.7 t -75.23 -32.58 61.17 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 121.147 -0.221 . . . . 0.0 110.86 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' B' ' 666' ' ' TRP . 0.0 OUTLIER -65.29 -12.61 53.44 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.686 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 14.1 m95 -68.22 -19.41 64.74 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.112 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -89.46 -47.95 7.65 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 672' ' ' TRP . . . . . 0.429 ' CH2' HD22 ' B' ' 669' ' ' LEU . 6.1 p-90 -103.16 -23.51 13.64 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 -177.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 51.15 -3.45 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 116.228 1.936 . . . . 0.0 116.228 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -53.27 55.69 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 120.217 1.371 . . . . 0.0 113.68 -177.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.32 -27.93 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 119.639 -0.825 . . . . 0.0 110.755 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.3 m -59.11 -50.06 75.49 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.105 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -69.03 -20.95 64.14 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.542 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 8.2 t90 -72.19 -46.86 54.55 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.43 -10.45 32.42 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -92.55 -15.44 26.97 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 119.886 -0.725 . . . . 0.0 112.226 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -114.04 -31.53 6.33 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.43 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 23.8 mm -65.59 -44.66 93.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-O 119.24 -0.41 . . . . 0.0 111.48 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -42.7 76.63 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.172 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 84.4 mt -68.7 -41.96 82.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.409 ' HA ' HD13 ' B' ' 688' ' ' ILE . 10.9 t80 -52.79 -28.86 24.38 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.024 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.686 HG21 HD12 ' C' ' 686' ' ' ILE . 1.4 mp -58.73 -37.61 67.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.5 mt -58.54 -41.87 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 688' ' ' ILE . . . . . 0.513 ' N ' HD12 ' B' ' 688' ' ' ILE . 2.7 mp -62.34 -41.28 91.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.451 ' O ' HG12 ' B' ' 689' ' ' VAL . 47.2 t -67.86 -4.14 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.305 -179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.46 -45.11 7.06 Favored Glycine 0 C--N 1.348 1.24 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 2.5 m -69.76 -22.9 63.31 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.856 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -54.34 -32.94 57.9 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.964 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 1.9 pp -65.2 -38.21 82.08 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.808 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 694' ' ' GLY . . . . . 0.687 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -64.58 -51.73 49.43 Favored Glycine 0 C--O 1.213 -1.172 0 N-CA-C 111.15 -0.78 . . . . 0.0 111.15 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.428 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.4 OUTLIER -56.72 -42.25 78.87 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.366 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -30.27 13.99 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.687 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.6 tp -58.63 -40.54 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -175.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.428 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -55.88 -28.03 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 118.306 0.503 . . . . 0.0 111.773 -178.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -55.29 -26.98 43.71 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.275 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.77 -35.61 63.97 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.145 178.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 64.8 t -59.86 -32.73 50.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.926 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 1.1 pp -61.44 -30.79 70.8 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.296 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.6 t -58.1 -36.19 72.51 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.988 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 704' ' ' LEU . . . . . 0.492 ' O ' HG12 ' B' ' 708' ' ' VAL . 18.0 tp -63.93 -32.39 73.9 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.235 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 21.4 t -83.08 -33.71 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 120.969 -0.293 . . . . 0.0 110.375 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -65.28 -34.32 78.07 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.579 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.57 -33.54 62.7 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.56 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.51 HG22 ' O ' ' B' ' 708' ' ' VAL . 9.9 p -111.11 26.11 3.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.292 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -49.35 111.21 0.46 Allowed 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.95 -0.3 . . . . 0.0 111.226 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.976 -179.888 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.515 HD12 ' CD1' ' B' ' 666' ' ' TRP . 3.4 mt -73.45 -172.01 1.1 Allowed 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -144.89 106.93 4.3 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.07 -33.12 68.71 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.359 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -60.55 -23.9 64.98 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.658 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 665' ' ' LYS . . . . . 0.446 ' CE ' HG21 ' C' ' 675' ' ' ILE . 7.7 tmtt? -70.13 -41.68 73.6 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.15 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 666' ' ' TRP . . . . . 0.79 ' O ' HD12 ' C' ' 669' ' ' LEU . 76.2 m95 -73.05 -33.89 65.95 Favored 'General case' 0 C--O 1.214 -0.803 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.041 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -83.2 -30.75 27.51 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.013 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 3.3 p -56.23 -30.92 63.0 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.6 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.79 HD12 ' O ' ' C' ' 666' ' ' TRP . 0.0 OUTLIER -55.37 -10.97 0.69 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -177.78 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 670' ' ' TRP . . . . . 0.762 ' N ' HD13 ' C' ' 669' ' ' LEU . 20.6 m95 -68.19 -31.1 70.39 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.451 -0.9 . . . . 0.0 109.915 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -83.29 -50.0 8.83 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 119.642 -0.823 . . . . 0.0 112.791 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 672' ' ' TRP . . . . . 0.533 ' CZ3' HG22 ' C' ' 675' ' ' ILE . 4.8 p-90 -97.94 -23.53 15.78 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 116.296 1.961 . . . . 0.0 116.296 -178.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 54.89 -7.38 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 121.453 1.933 . . . . 0.0 115.758 177.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -63.47 -53.06 58.04 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.533 HG22 ' CZ3' ' C' ' 672' ' ' TRP . 0.4 OUTLIER -69.08 -40.03 80.23 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 C-N-CA 118.88 -1.128 . . . . 0.0 112.617 -178.199 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 676' ' ' THR . . . . . 0.524 ' HB ' HD23 ' C' ' 669' ' ' LEU . 77.2 m -63.61 -33.78 76.37 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.926 -179.015 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -64.79 -47.09 79.36 Favored 'General case' 0 C--O 1.21 -0.995 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.113 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.487 ' O ' HG23 ' C' ' 682' ' ' ILE . 2.5 t90 -72.31 -45.99 57.61 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.154 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.554 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -71.57 -32.86 68.54 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.735 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -110.37 62.29 0.6 Allowed 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -173.92 -33.99 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.231 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.487 HG23 ' O ' ' C' ' 678' ' ' TRP . 16.3 pt -55.19 -36.89 41.39 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.723 0 CA-C-O 119.324 -0.369 . . . . 0.0 111.88 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 10.9 mtp180 -56.69 -48.32 77.93 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.434 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 81.1 mt -67.56 -44.48 86.39 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.562 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.291 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.484 ' HA ' HD12 ' C' ' 688' ' ' ILE . 4.7 m-85 -53.06 -28.45 24.81 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.907 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.686 HD12 HG21 ' B' ' 686' ' ' ILE . 14.8 mm -58.29 -40.11 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 120.023 -0.671 . . . . 0.0 110.098 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.5 mt -59.78 -42.11 87.76 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.601 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.484 HD12 ' HA ' ' C' ' 685' ' ' PHE . 66.6 mt -65.1 -41.44 91.86 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.129 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.617 ' O ' HD12 ' C' ' 692' ' ' LEU . 96.2 t -67.48 -22.34 28.61 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.171 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.872 -176.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.01 -4.13 90.36 Favored Glycine 0 CA--C 1.55 2.251 0 CA-C-N 119.668 1.122 . . . . 0.0 113.665 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 43.3 m -88.82 -34.7 16.95 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.76 1.28 . . . . 0.0 113.223 -178.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 692' ' ' LEU . . . . . 0.898 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -64.79 -31.75 73.12 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.073 -178.775 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.898 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.0 OUTLIER -69.03 -29.17 42.23 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 179.268 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.69 -40.85 95.38 Favored Glycine 0 CA--C 1.541 1.707 0 C-N-CA 120.193 -1.003 . . . . 0.0 110.97 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.507 HD23 ' O ' ' C' ' 695' ' ' LEU . 1.3 tt -56.8 -34.08 67.31 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.27 -34.83 24.65 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.699 ' O ' HD13 ' C' ' 697' ' ' ILE . 0.2 OUTLIER -58.27 -40.69 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -175.469 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.404 HG12 ' O ' ' C' ' 695' ' ' LEU . 8.2 p -56.02 -28.93 25.74 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.924 0 CA-C-N 119.187 0.903 . . . . 0.0 111.064 -178.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 699' ' ' PHE . . . . . 0.439 ' O ' HD23 ' C' ' 702' ' ' LEU . 0.1 OUTLIER -57.6 -35.45 70.45 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.759 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.7 -35.62 66.26 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -177.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.84 -31.47 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.799 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 702' ' ' LEU . . . . . 0.439 HD23 ' O ' ' C' ' 699' ' ' PHE . 1.4 pp -58.54 -25.52 62.56 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.943 -179.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 74.2 m -57.85 -38.35 75.52 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.332 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 704' ' ' LEU . . . . . 0.574 HD13 ' O ' ' C' ' 704' ' ' LEU . 0.5 OUTLIER -60.15 -39.14 85.31 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.355 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.8 t -69.91 -18.82 22.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.868 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -60.67 -16.65 41.36 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 707' ' ' ARG . . . . . 0.539 ' HG3' HG23 ' C' ' 708' ' ' VAL . 13.7 ptm180 -73.87 -37.57 64.7 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.703 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 708' ' ' VAL . . . . . 0.539 HG23 ' HG3' ' C' ' 707' ' ' ARG . 21.0 t -96.46 9.5 6.17 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.801 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 15.2 tpp85 63.44 138.77 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 O-C-N 122.267 -0.271 . . . . 0.0 110.874 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 C--O 1.219 -0.548 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.538 179.804 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.654 ' CG ' HD23 ' C' ' 663' ' ' LEU . 10.1 tt . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.623 HD23 ' CE2' ' A' ' 666' ' ' TRP . 1.5 tp -150.72 -54.72 0.15 Allowed 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.393 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 48.42 177.39 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.529 HD12 ' HB2' ' B' ' 660' ' ' LEU . 8.1 tt -52.33 -38.59 58.99 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 114.254 -1.339 . . . . 0.0 111.588 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -60.97 -41.81 97.09 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -177.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 665' ' ' LYS . . . . . 0.417 ' HG3' ' HA ' ' A' ' 661' ' ' LEU . 23.7 mmtp -71.11 -44.51 65.5 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 118.869 -1.133 . . . . 0.0 112.497 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 666' ' ' TRP . . . . . 0.623 ' CE2' HD23 ' A' ' 661' ' ' LEU . 85.5 m95 -59.04 -39.2 81.26 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.955 -179.006 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.23 -39.65 94.4 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.238 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 32.2 t -58.11 -32.68 68.34 Favored 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.557 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.505 HD22 ' OG1' ' A' ' 676' ' ' THR . 0.4 OUTLIER -69.7 -7.76 42.06 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.43 179.812 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 33.8 m0 -75.28 -6.75 51.44 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -62.57 -48.96 77.17 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.283 -179.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.72 -22.53 13.54 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 19.1 p90 49.67 -3.07 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -63.71 -53.55 49.38 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-N 120.355 1.434 . . . . 0.0 110.165 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 14.6 mm -69.43 -27.84 35.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.469 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 676' ' ' THR . . . . . 0.505 ' OG1' HD22 ' A' ' 669' ' ' LEU . 32.9 m -58.92 -48.63 80.79 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -64.92 -34.84 79.37 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.456 ' O ' HG23 ' A' ' 682' ' ' ILE . 28.5 t90 -64.38 -19.91 65.79 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.765 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -84.96 -2.68 58.2 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 120.297 -0.561 . . . . 0.0 112.195 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 53.9 t-105 -145.16 -43.93 0.23 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 120.123 -0.631 . . . . 0.0 112.108 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -66.22 -13.08 59.76 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.456 HG23 ' O ' ' A' ' 678' ' ' TRP . 13.7 pt -55.33 -36.15 39.39 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.721 0 C-N-CA 120.536 -0.465 . . . . 0.0 110.935 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.54 ' NH2' HD22 ' B' ' 679' ' ' LEU . 26.0 ttp180 -54.86 -32.77 61.08 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.894 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 45.2 mm -59.69 -48.28 88.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.066 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -67.82 -28.2 67.37 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.543 HD12 HG21 ' C' ' 686' ' ' ILE . 29.2 mm -58.12 -43.16 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.451 0.569 . . . . 0.0 111.853 -177.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 63.4 mt -58.29 -41.88 82.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.024 -179.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 47.5 mt -62.83 -41.49 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.619 ' O ' HD11 ' A' ' 692' ' ' LEU . 60.5 t -68.21 -3.96 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -177.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -101.5 6.21 55.26 Favored Glycine 0 CA--C 1.543 1.794 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.846 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 14.6 m -88.31 -34.23 17.73 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 117.4 0.6 . . . . 0.0 111.781 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.619 HD11 ' O ' ' A' ' 689' ' ' VAL . 0.2 OUTLIER -54.0 -32.64 54.76 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.488 -178.496 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.718 HD13 ' O ' ' A' ' 693' ' ' ILE . 0.2 OUTLIER -61.75 -37.9 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.529 -179.013 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.82 -36.82 74.91 Favored Glycine 0 C--O 1.212 -1.219 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.76 -36.44 69.79 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.53 ' HG3' HD11 ' C' ' 693' ' ' ILE . 86.6 mmt-85 -52.76 -35.94 57.15 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -178.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 697' ' ' ILE . . . . . 0.433 HD12 ' N ' ' A' ' 698' ' ' VAL . 2.3 pp -59.15 -41.82 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.688 ' O ' HG12 ' A' ' 701' ' ' VAL . 9.2 p -64.88 -29.57 47.79 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.815 0 C-N-CA 118.889 -1.124 . . . . 0.0 111.272 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -55.8 -35.57 66.46 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 121.129 -0.228 . . . . 0.0 110.897 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.91 -35.6 66.77 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.978 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.688 HG12 ' O ' ' A' ' 698' ' ' VAL . 1.7 p -59.91 -33.11 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.914 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.6 tt -65.86 -29.84 70.35 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.182 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 42.3 p -57.59 -47.42 82.15 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.698 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.52 -39.39 94.31 Favored 'General case' 0 C--O 1.215 -0.719 0 CA-C-N 116.34 -0.391 . . . . 0.0 109.95 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 73.8 t -60.85 -15.38 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -80.23 -12.63 59.61 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -73.82 -27.79 61.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 120.091 -0.644 . . . . 0.0 111.579 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 39.1 t -82.81 -36.08 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.438 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.94 179.14 5.05 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.396 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.848 -179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.529 ' HB2' HD12 ' A' ' 663' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.427 HD12 ' CZ2' ' B' ' 666' ' ' TRP . 4.5 mm? -108.3 119.18 38.75 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.936 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -137.98 162.08 35.02 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.381 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.452 HD23 ' C ' ' B' ' 663' ' ' LEU . 10.6 tt -59.18 -40.17 84.84 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.932 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -73.79 -25.32 60.07 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.913 -179.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -68.82 -46.15 69.36 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.783 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 666' ' ' TRP . . . . . 0.427 ' CZ2' HD12 ' B' ' 661' ' ' LEU . 95.6 m95 -64.52 -53.58 45.79 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 120.834 -0.347 . . . . 0.0 110.856 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 667' ' ' ALA . . . . . 0.5 ' HB2' HD13 ' C' ' 660' ' ' LEU . . . -58.48 -23.13 56.99 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.116 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.92 -33.29 70.39 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.877 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 68.9 mt -65.03 -17.52 64.52 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -68.51 -2.9 9.79 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 120.612 -0.435 . . . . 0.0 112.002 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -73.32 -48.61 32.98 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.231 -0.588 . . . . 0.0 112.2 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.88 -23.17 13.4 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.82 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 42.8 t80 58.92 -12.25 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -63.55 -52.56 60.58 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 119.345 0.975 . . . . 0.0 111.636 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.496 HD11 HD23 ' B' ' 679' ' ' LEU . 6.6 tp -68.46 -27.77 37.84 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.971 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.613 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 25.8 m -58.41 -41.77 85.71 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.405 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -62.75 -45.56 92.15 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.827 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -72.14 -37.3 69.47 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.064 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 679' ' ' LEU . . . . . 0.54 HD22 ' NH2' ' A' ' 683' ' ' ARG . 0.2 OUTLIER -78.66 -3.09 42.31 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -178.149 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -120.37 -35.2 3.47 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 120.138 -0.625 . . . . 0.0 112.115 -178.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -66.52 -7.69 21.65 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.295 -0.562 . . . . 0.0 112.156 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.546 ' O ' HD13 ' B' ' 686' ' ' ILE . 0.2 OUTLIER -67.8 -46.27 82.72 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 119.926 -0.71 . . . . 0.0 112.535 -179.326 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 37.3 ptt180 -62.96 -42.8 99.93 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 118.58 0.627 . . . . 0.0 111.654 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 94.7 mt -65.7 -43.98 93.5 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -57.27 -34.18 68.39 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.22 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.905 HG21 HD11 ' C' ' 686' ' ' ILE . 1.1 mp -58.72 -46.14 90.73 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 62.7 mt -58.65 -41.6 82.66 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.548 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 15.6 mm -59.64 -42.92 89.99 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.547 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 75.3 t -68.38 -15.74 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 CA-C-O 119.277 -0.392 . . . . 0.0 111.885 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -71.27 -54.18 9.36 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 44.1 m -64.44 -23.22 67.21 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.291 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.99 -32.77 55.09 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.565 -178.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 2.4 pp -65.3 -39.37 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.097 -178.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.18 -48.06 78.71 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.098 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.406 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.1 mt -56.83 -42.25 79.29 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 117.153 0.477 . . . . 0.0 111.9 -178.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.48 -29.92 11.57 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.743 HD11 ' HD3' ' C' ' 696' ' ' ARG . 41.7 mm -58.44 -40.57 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 CA-C-O 119.023 -0.513 . . . . 0.0 111.679 -176.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.406 HG12 ' O ' ' B' ' 695' ' ' LEU . 5.4 p -55.76 -28.16 23.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 118.652 0.66 . . . . 0.0 111.296 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -55.35 -26.84 43.37 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.346 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.66 54.23 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.006 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.99 -34.92 58.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.219 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.33 -35.23 73.44 Favored 'General case' 0 C--O 1.219 -0.522 0 O-C-N 123.007 0.192 . . . . 0.0 110.608 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.6 t -57.98 -31.85 67.31 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.855 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 6.9 tp -60.65 -42.5 97.11 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 61.1 t -73.69 -19.82 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -64.44 -8.63 14.2 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 28.2 mtt180 -73.96 -40.95 62.66 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.175 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 34.9 t -87.52 -36.19 9.34 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.784 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 -122.26 145.32 48.34 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.138 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 . . . . . 0 C--O 1.221 -0.424 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.683 -179.925 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' B' ' 667' ' ' ALA . 58.1 mt . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 2.1 tp -45.77 142.07 2.67 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 111.45 0.167 . . . . 0.0 111.45 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 662' ' ' GLU . . . . . 0.434 ' HG3' HD12 ' B' ' 663' ' ' LEU . 2.0 mt-10 -169.7 165.69 9.97 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.197 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.691 HD13 ' H ' ' C' ' 664' ' ' ASP . 0.0 OUTLIER -58.09 -31.12 66.8 Favored 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.509 -179.416 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 664' ' ' ASP . . . . . 0.691 ' H ' HD13 ' C' ' 663' ' ' LEU . 6.2 t70 -74.22 -27.43 60.79 Favored 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -63.28 -42.31 99.08 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.321 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -58.74 -31.41 68.29 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.55 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.89 -16.17 6.25 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.513 178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 17.6 m -53.23 -32.96 50.86 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.45 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' C' ' 673' ' ' PHE . 11.9 tp -55.83 -13.44 1.78 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.841 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -69.59 -43.44 72.79 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -177.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -88.78 -52.01 5.35 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 117.25 -1.78 . . . . 0.0 113.67 -177.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 672' ' ' TRP . . . . . 0.511 ' HE1' ' C18' ' C' ' 801' ' ' QOJ 0.258 6.0 p-90 -103.96 -21.96 13.55 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 178.142 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 673' ' ' PHE . . . . . 0.437 ' HA ' HD12 ' C' ' 669' ' ' LEU . 2.2 t80 72.53 -27.77 0.19 Allowed 'General case' 0 C--N 1.373 1.622 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 674' ' ' ASP . . . . . 0.425 ' HB2' ' CE3' ' C' ' 672' ' ' TRP . 0.1 OUTLIER -64.26 -53.08 54.65 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -175.419 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 10.9 tp -69.76 -48.8 62.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 CA-C-N 120.946 1.703 . . . . 0.0 115.25 -176.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 676' ' ' THR . . . . . 0.404 ' HB ' ' CD1' ' C' ' 669' ' ' LEU . 19.8 m -61.27 -33.88 74.26 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 118.973 -1.091 . . . . 0.0 109.123 -178.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -62.84 -17.5 61.46 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.082 177.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.406 ' O ' HD13 ' C' ' 682' ' ' ILE . 19.6 t90 -71.89 -44.66 63.37 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.501 ' N ' HD12 ' C' ' 679' ' ' LEU . 7.5 mp -67.93 -2.77 8.07 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.596 -178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.35 168.85 18.16 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 78.49 -39.05 0.25 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.541 0.736 . . . . 0.0 110.711 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.406 HD13 ' O ' ' C' ' 678' ' ' TRP . 1.7 mp -58.77 -36.8 62.54 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -55.83 -44.47 77.96 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.061 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 44.3 mt -68.33 -36.81 76.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.347 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -52.01 -30.21 24.3 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.905 HD11 HG21 ' B' ' 686' ' ' ILE . 1.8 mp -64.07 -42.98 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 65.6 mt -58.84 -41.22 82.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 46.5 mm -56.8 -41.86 76.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.495 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 57.4 t -67.81 -31.51 52.55 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 119.904 -0.719 . . . . 0.0 111.358 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 690' ' ' GLY . . . . . 0.448 ' O ' HG22 ' C' ' 693' ' ' ILE . . . -55.09 -47.68 72.18 Favored Glycine 0 C--N 1.353 1.506 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.6 -33.98 76.88 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.169 178.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.2 tp -62.04 -57.06 13.05 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.612 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.771 HD13 ' O ' ' C' ' 693' ' ' ILE . 0.1 OUTLIER -55.96 -29.07 25.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.128 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.24 -41.09 94.7 Favored Glycine 0 CA--C 1.541 1.695 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.667 ' O ' HG22 ' C' ' 698' ' ' VAL . 0.9 OUTLIER -56.54 -31.22 63.95 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 117.369 0.584 . . . . 0.0 111.223 179.396 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.743 ' HD3' HD11 ' B' ' 697' ' ' ILE . 1.5 mmt180 -49.78 -35.24 21.86 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 6.9 tp -58.68 -40.92 80.84 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -175.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.667 HG22 ' O ' ' C' ' 695' ' ' LEU . 16.4 m -55.91 -28.5 24.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 CA-C-N 119.305 0.957 . . . . 0.0 111.31 -178.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -55.63 -35.5 65.98 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.299 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.81 -39.02 70.76 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.015 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 75.2 t -68.05 -39.79 82.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.92 -28.8 66.57 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.512 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 23.4 p -59.92 -35.52 75.06 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.652 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.2 tp -59.11 -40.62 85.91 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 20.1 t -66.29 -19.8 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.594 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -60.76 -10.91 6.12 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 23.0 ptt85 -101.02 -12.76 18.62 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 55.9 t -82.86 -30.86 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.226 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 83.4 mtm-85 -54.37 124.99 17.68 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.27 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 . . . . . 0 C--O 1.219 -0.508 0 CA-C-O 117.912 -1.042 . . . . 0.0 110.811 179.844 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . 0.511 ' C18' ' HE1' ' C' ' 672' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.46 HD22 ' CD1' ' C' ' 666' ' ' TRP . 5.4 tp -67.11 -146.74 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -169.34 96.34 0.33 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.367 0.53 . . . . 0.0 110.919 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.515 ' C ' HD23 ' A' ' 663' ' ' LEU . 9.9 tt -67.08 -40.43 87.01 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-O 120.929 0.395 . . . . 0.0 111.368 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -68.21 -23.5 64.83 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.248 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -67.26 -34.6 77.77 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.709 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -61.08 -35.74 77.79 Favored 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.512 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 667' ' ' ALA . . . . . 0.401 ' HB2' HD22 ' B' ' 660' ' ' LEU . . . -92.37 -19.26 22.28 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.97 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 75.5 m -73.91 -37.34 64.68 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.044 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.531 HD12 ' C ' ' A' ' 669' ' ' LEU . 4.4 pp -63.48 -9.06 11.05 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.889 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -68.34 -19.73 64.67 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.219 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -84.67 -48.13 9.78 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 4.5 p90 -100.95 -22.74 14.7 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 118.082 0.401 . . . . 0.0 111.967 -178.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 48.58 16.64 0.11 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -63.4 -54.03 43.13 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.18 -177.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.626 HD12 HD12 ' A' ' 679' ' ' LEU . 0.3 OUTLIER -69.77 -31.32 47.96 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 C-N-CA 119.699 -0.8 . . . . 0.0 110.704 178.291 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 13.8 m -58.26 -33.84 69.84 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.459 -178.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -59.69 -44.05 93.8 Favored 'General case' 0 C--O 1.215 -0.753 0 C-N-CA 119.817 -0.753 . . . . 0.0 108.973 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -72.82 -46.09 54.94 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.451 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.626 HD12 HD12 ' A' ' 675' ' ' ILE . 14.1 mt -67.57 -2.87 7.34 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -177.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.7 m95 -133.23 142.51 48.6 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 92.12 -32.51 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.232 1.013 . . . . 0.0 111.277 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.613 HD12 ' N ' ' A' ' 683' ' ' ARG . 2.7 pp -68.09 -41.23 84.13 Favored 'Isoleucine or valine' 0 C--N 1.35 0.624 0 C-N-CA 119.315 -0.954 . . . . 0.0 109.55 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.613 ' N ' HD12 ' A' ' 682' ' ' ILE . 54.3 ttp180 -69.28 -47.08 65.62 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.98 -37.43 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.734 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -52.19 -43.72 64.34 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.865 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.484 HG12 HG22 ' C' ' 686' ' ' ILE . 1.9 mp -58.73 -37.91 68.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.753 179.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 39.6 mm -58.04 -42.13 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 80.2 mt -59.86 -41.19 84.94 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 176.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.664 HG13 HG21 ' C' ' 693' ' ' ILE . 57.2 t -67.51 -25.41 33.15 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.593 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.76 -32.28 81.12 Favored Glycine 0 C--N 1.35 1.336 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.9 m -86.16 -31.82 21.59 Favored 'General case' 0 C--O 1.219 -0.529 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.418 HD23 HD12 ' C' ' 693' ' ' ILE . 5.2 tp -59.69 -44.63 93.58 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.009 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.555 HD11 ' CG ' ' B' ' 696' ' ' ARG . 4.1 tp -55.58 -35.85 39.88 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.988 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -72.61 -40.11 54.44 Favored Glycine 0 C--O 1.215 -1.078 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.799 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.8 OUTLIER -56.8 -40.21 75.51 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 120.861 0.362 . . . . 0.0 110.886 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.747 ' HG3' HD11 ' C' ' 693' ' ' ILE . 40.4 mmt180 -53.31 -35.21 59.91 Favored 'General case' 0 C--O 1.214 -0.789 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 697' ' ' ILE . . . . . 0.672 HD13 ' O ' ' A' ' 697' ' ' ILE . 0.2 OUTLIER -58.27 -40.69 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 120.451 -0.499 . . . . 0.0 112.008 -176.019 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.799 HG12 ' O ' ' A' ' 695' ' ' LEU . 12.4 p -55.96 -28.26 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.021 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -55.41 -35.88 65.85 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.602 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.02 -35.71 67.15 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.435 -0.506 . . . . 0.0 109.763 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 92.6 t -65.77 -34.36 69.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 9.0 tp -60.28 -29.84 69.08 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.915 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 26.8 m -57.95 -45.52 86.51 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.657 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 15.0 tp -64.88 -39.99 94.42 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 78.0 t -69.73 -24.94 27.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.56 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -71.0 -31.38 67.89 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.402 ' HG3' HG13 ' A' ' 708' ' ' VAL . 0.1 OUTLIER -74.38 -23.11 58.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.843 -179.172 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.402 HG13 ' HG3' ' A' ' 707' ' ' ARG . 33.9 m -99.36 25.97 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 C-N-CA 120.534 -0.467 . . . . 0.0 111.259 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -51.09 70.85 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.357 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.83 179.741 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.401 HD22 ' HB2' ' A' ' 667' ' ' ALA . 9.8 tp . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 60.3 mt 61.13 123.61 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.344 0.403 . . . . 0.0 111.091 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -158.32 176.94 11.82 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.99 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.74 -39.52 88.99 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.486 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.09 -28.23 64.18 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.693 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -69.95 -46.02 66.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.741 -179.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -70.14 -37.58 75.29 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.591 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.32 -41.96 80.07 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.0 p -54.48 -31.5 55.93 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.475 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.851 HD21 HG23 ' B' ' 675' ' ' ILE . 13.0 tp -61.84 -10.5 9.33 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.918 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 670' ' ' TRP . . . . . 0.416 ' HZ2' HD13 ' C' ' 660' ' ' LEU . 37.8 m0 -68.4 -25.51 65.08 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.885 -0.726 . . . . 0.0 111.112 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -62.98 -46.29 88.41 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -23.91 13.6 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 120.009 -0.676 . . . . 0.0 111.447 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 72.7 t80 45.56 10.47 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -64.13 -54.7 29.66 Favored 'General case' 0 C--N 1.354 0.782 0 CA-C-N 119.74 1.155 . . . . 0.0 113.356 -177.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.851 HG23 HD21 ' B' ' 669' ' ' LEU . 9.2 tp -69.98 -27.58 33.27 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.914 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.838 178.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 9.4 m -58.71 -45.9 88.52 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.898 -178.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -61.81 -47.19 86.24 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.264 -0.575 . . . . 0.0 111.557 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.403 ' CE3' HD12 ' B' ' 675' ' ' ILE . 3.6 t90 -72.21 -42.04 66.21 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 7.9 tp -74.25 -33.01 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -177.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -96.28 23.95 6.19 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.204 -0.599 . . . . 0.0 112.326 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -137.9 11.47 2.88 Favored 'General case' 0 C--O 1.218 -0.583 0 C-N-CA 120.396 -0.521 . . . . 0.0 111.549 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.433 HD13 ' HD2' ' A' ' 683' ' ' ARG . 16.8 pt -65.05 -43.3 95.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 87.9 mtm-85 -59.69 -46.18 89.85 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.105 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.487 HD12 ' N ' ' B' ' 684' ' ' ILE . 2.0 mp -68.33 -39.22 80.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.132 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -62.27 -51.16 68.82 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.521 HG21 HD12 ' C' ' 686' ' ' ILE . 2.6 mp -65.14 -39.82 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.491 -178.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 80.4 mt -58.75 -41.71 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.855 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 55.3 mt -58.54 -41.63 82.41 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 61.2 t -67.79 -29.4 44.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.878 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.92 -43.33 96.82 Favored Glycine 0 C--N 1.35 1.351 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -34.09 73.81 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 3.7 tp -63.53 -43.38 97.3 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.944 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.49 HG12 HD13 ' A' ' 693' ' ' ILE . 0.4 OUTLIER -66.13 -39.1 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.822 -179.138 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.81 -42.09 87.28 Favored Glycine 0 CA--C 1.531 1.045 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.15 -31.44 63.35 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 120.743 0.306 . . . . 0.0 110.31 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.555 ' CG ' HD11 ' A' ' 693' ' ' ILE . 2.0 tpm_? -50.71 -31.9 17.88 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 122.814 0.446 . . . . 0.0 111.896 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 45.5 mt -60.17 -42.87 91.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.356 -177.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.524 ' O ' HG22 ' B' ' 701' ' ' VAL . 44.2 t -57.0 -28.94 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.517 -178.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -25.41 39.91 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.215 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.72 -35.52 22.29 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 701' ' ' VAL . . . . . 0.524 HG22 ' O ' ' B' ' 698' ' ' VAL . 33.8 m -59.82 -32.03 48.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 120.07 -0.652 . . . . 0.0 110.668 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 20.0 tp -60.26 -38.3 83.09 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.799 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 6.4 t -57.93 -38.87 76.7 Favored 'General case' 0 C--O 1.22 -0.479 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.975 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.9 tp -65.78 -42.8 90.36 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.072 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 39.8 t -71.25 -23.72 23.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.601 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.69 -14.82 62.03 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.16 -30.97 17.28 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.531 -179.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 34.8 m -88.39 -25.61 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.492 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -96.79 140.04 31.95 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.742 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.758 179.944 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.416 HD13 ' HZ2' ' B' ' 670' ' ' TRP . 23.1 tp . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 tp -143.49 113.39 7.15 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -146.09 163.76 34.28 Favored 'General case' 0 C--O 1.218 -0.582 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.744 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.425 HD23 ' HB3' ' A' ' 661' ' ' LEU . 10.5 mt -61.42 -38.78 88.35 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.851 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.87 -28.62 62.61 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.534 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -70.23 -44.13 69.21 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.154 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 666' ' ' TRP . . . . . 0.46 ' CD1' HD22 ' A' ' 661' ' ' LEU . 78.6 m95 -60.56 -57.05 14.37 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.368 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.57 -47.02 77.09 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.146 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 78.6 p -60.2 -31.94 70.63 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 123.224 0.328 . . . . 0.0 111.179 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.536 HD11 ' C19' ' C' ' 801' ' ' QOJ . 11.9 tp -64.19 -4.64 3.82 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -68.27 -6.59 24.65 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.818 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -63.17 -37.06 85.73 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -79.84 -22.68 42.69 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -176.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 64.23 -71.42 0.07 Allowed 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.198 1.363 . . . . 0.0 112.462 178.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -50.84 -49.69 58.32 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 46.1 mm -65.96 -40.53 87.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.666 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.2 m -58.93 -49.82 76.38 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.146 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -67.74 -40.53 84.15 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.516 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -60.53 -36.84 79.38 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.531 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 5.9 tp -76.9 -14.25 59.9 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 3.3 t90 -111.16 -19.12 12.82 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -95.0 -38.25 10.75 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.626 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 47.5 mm -57.57 -36.9 55.67 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.512 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.659 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.7 -33.91 66.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.06 178.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -68.0 -41.58 84.67 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -56.25 -28.05 57.17 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.883 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.521 HD12 HG21 ' B' ' 686' ' ' ILE . 36.8 mm -58.2 -45.44 88.84 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.577 -177.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 41.1 mt -65.42 -40.79 89.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 21.2 mm -55.95 -41.13 66.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.496 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.734 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 61.3 t -67.12 -23.66 30.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 120.033 -0.667 . . . . 0.0 111.942 -178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 690' ' ' GLY . . . . . 0.59 ' O ' HG22 ' C' ' 693' ' ' ILE . . . -59.63 -51.35 59.55 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-N 119.189 0.904 . . . . 0.0 111.555 179.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 2.0 m -72.72 -21.89 60.97 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 117.247 0.523 . . . . 0.0 112.181 -179.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.7 tp -55.95 -38.27 70.11 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.888 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.747 HD11 ' HG3' ' A' ' 696' ' ' ARG . 0.0 OUTLIER -73.77 -23.03 18.89 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.579 -179.801 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.48 -47.43 89.91 Favored Glycine 0 CA--C 1.542 1.76 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.102 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.506 HD23 ' O ' ' C' ' 695' ' ' LEU . 1.0 OUTLIER -56.54 -30.69 63.37 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.257 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -49.65 -34.92 19.69 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -177.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.593 HD13 ' NH2' ' A' ' 696' ' ' ARG . 7.2 tp -58.17 -40.27 76.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -175.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.456 HG12 ' O ' ' C' ' 695' ' ' LEU . 9.6 p -55.72 -28.55 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 CA-C-N 118.968 0.804 . . . . 0.0 111.449 -178.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -55.65 -35.32 65.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.37 -35.97 65.85 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.318 -177.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 77.5 t -64.73 -31.66 54.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 120.181 -0.608 . . . . 0.0 109.77 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.9 tp -58.83 -40.76 85.13 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.77 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 95.1 p -62.32 -33.92 75.61 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.141 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 19.5 tp -60.39 -42.9 96.86 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.13 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 27.2 m -83.2 -11.53 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.735 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -67.38 -21.05 65.63 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.45 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -73.53 -39.64 64.62 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.498 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 46.4 t -89.4 -35.94 8.16 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.236 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -120.89 158.79 26.89 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.308 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.41 -179.986 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . 0.438 ' C9 ' HD11 ' A' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . 0.536 ' C19' HD11 ' C' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.444 ' O ' ' O ' ' A' ' 661' ' ' LEU . 3.0 mp . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.467 ' O ' HD12 ' C' ' 663' ' ' LEU . 3.9 pp 39.75 -176.16 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 172.73 -179.07 0.07 Allowed 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.128 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.689 ' O ' HD22 ' A' ' 663' ' ' LEU . 0.0 OUTLIER -58.88 -40.59 84.84 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-O 120.791 0.329 . . . . 0.0 110.244 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 664' ' ' ASP . . . . . 0.689 ' N ' HD13 ' A' ' 663' ' ' LEU . 37.0 t70 -73.94 -23.97 59.59 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.851 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -67.06 -45.45 77.33 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.293 -179.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -64.47 -38.61 91.64 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.978 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 667' ' ' ALA . . . . . 0.675 ' HB2' ' CD1' ' B' ' 660' ' ' LEU . . . -72.8 -47.18 48.66 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.508 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 89.9 p -59.58 -31.64 69.63 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.038 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.611 HD11 HG22 ' A' ' 675' ' ' ILE . 56.6 tp -56.47 -26.78 55.15 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.062 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -68.54 -9.95 52.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 119.512 -0.875 . . . . 0.0 111.997 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -62.76 -48.85 77.37 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.583 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.68 -22.57 13.55 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.347 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 48.2 p90 41.39 22.05 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -63.89 -52.8 58.28 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.782 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.611 HG22 HD11 ' A' ' 669' ' ' LEU . 0.3 OUTLIER -68.67 -33.22 58.49 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.748 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.581 -179.202 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 51.7 p -58.44 -37.78 76.13 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.619 -178.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -60.57 -41.64 95.03 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.344 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 7.0 t90 -72.81 -46.42 53.22 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 679' ' ' LEU . 0.6 OUTLIER -91.54 -33.46 15.15 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.593 0.961 . . . . 0.0 113.593 -176.138 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.15 -11.02 60.38 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.287 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -110.16 -30.1 7.89 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 121.093 -0.243 . . . . 0.0 110.603 179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.442 ' O ' HD13 ' A' ' 686' ' ' ILE . 1.2 mm -60.0 -43.83 93.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 45.9 ttp180 -62.2 -48.45 79.95 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.244 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 80.0 mt -64.12 -44.06 97.55 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.454 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -52.65 -27.83 18.93 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.771 HG21 HD11 ' B' ' 686' ' ' ILE . 1.2 mp -57.54 -48.38 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.218 -177.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 49.1 mt -58.59 -41.92 83.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.321 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 69.1 mt -60.19 -45.18 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.9 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 13.4 m -68.81 2.0 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 119.811 -0.755 . . . . 0.0 112.27 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -85.6 -64.2 1.51 Allowed Glycine 0 C--N 1.347 1.173 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 29.8 m -52.1 -25.16 8.12 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.611 -0.435 . . . . 0.0 110.683 178.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.636 HD23 HD11 ' C' ' 693' ' ' ILE . 2.3 tp -54.03 -32.58 54.79 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.785 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -35.39 73.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.156 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.919 -178.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.02 -56.28 5.87 Favored Glycine 0 CA--C 1.537 1.43 0 C-N-CA 120.007 -1.092 . . . . 0.0 113.767 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.753 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.0 OUTLIER -60.36 -31.6 70.48 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.992 1.396 . . . . 0.0 110.456 179.905 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.529 ' H ' HD13 ' A' ' 695' ' ' LEU . 20.1 tpp180 -50.74 -35.88 33.68 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-O 120.723 0.297 . . . . 0.0 110.348 177.621 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 58.1 mt -59.21 -40.35 80.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.782 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.753 HG12 ' O ' ' A' ' 695' ' ' LEU . 3.5 p -55.55 -28.06 22.27 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.807 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.347 -178.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -55.04 -35.4 64.42 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.929 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.78 -35.59 66.43 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.911 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.664 HG12 ' O ' ' A' ' 698' ' ' VAL . 1.7 p -59.88 -34.2 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.075 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.05 -24.84 67.86 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.284 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 32.1 m -57.87 -44.75 86.83 Favored 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.778 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.54 -40.39 92.84 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 61.6 t -60.61 -28.33 42.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.342 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -63.33 -7.33 6.13 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 11.2 ttp85 -73.6 -44.82 56.18 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.485 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 43.0 t -89.42 -36.03 8.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.219 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 38.23 46.99 0.94 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 58.3 tp60 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.017 -0.992 . . . . 0.0 111.037 179.753 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.675 ' CD1' ' HB2' ' A' ' 667' ' ' ALA . 55.8 mt . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.642 ' H ' HD23 ' A' ' 663' ' ' LEU . 0.2 OUTLIER -146.84 135.36 21.97 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.287 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -168.75 137.99 2.23 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.579 ' C ' HD22 ' B' ' 663' ' ' LEU . 0.0 OUTLIER -55.01 -18.25 4.89 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.356 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -72.48 -31.46 65.4 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 121.058 -0.257 . . . . 0.0 110.753 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -69.43 -44.91 70.36 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.369 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 85.4 m95 -66.23 -38.84 88.88 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.355 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.4 -35.83 71.17 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.144 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 2.9 t -54.98 -31.44 60.86 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.075 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.421 HD22 ' CH2' ' B' ' 672' ' ' TRP . 8.7 mt -62.9 -14.8 50.95 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.934 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -68.79 -28.27 66.62 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.962 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -62.83 -47.93 81.26 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.508 -0.477 . . . . 0.0 112.197 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 672' ' ' TRP . . . . . 0.59 ' CZ3' HG22 ' B' ' 675' ' ' ILE . 0.0 OUTLIER -103.44 -22.46 13.65 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.717 -178.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 53.45 7.83 0.11 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -63.45 -53.22 55.63 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.291 0.95 . . . . 0.0 112.276 -178.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.59 HG22 ' CZ3' ' B' ' 672' ' ' TRP . 8.8 tp -68.97 -32.8 55.98 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.75 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.632 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -59.02 -46.77 87.36 Favored 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.441 -178.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -64.68 -46.67 81.45 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.823 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.556 ' CE3' HD12 ' B' ' 675' ' ' ILE . 5.4 t90 -65.18 -38.19 89.74 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.088 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 679' ' ' LEU . . . . . 0.401 HD13 ' O ' ' B' ' 679' ' ' LEU . 0.1 OUTLIER -87.42 -19.34 28.2 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.717 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -100.61 9.68 42.17 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.619 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -129.99 -1.24 4.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.525 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.412 ' O ' HD12 ' B' ' 686' ' ' ILE . 12.7 tt -68.46 -44.18 83.4 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 17.1 ttm105 -55.81 -47.89 76.37 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.498 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 684' ' ' ILE . . . . . 0.5 HD12 ' N ' ' B' ' 684' ' ' ILE . 2.2 mp -64.54 -36.92 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.773 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.448 ' O ' HG23 ' B' ' 689' ' ' VAL . 46.1 t80 -52.01 -39.09 58.94 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 119.101 -0.476 . . . . 0.0 112.26 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.771 HD11 HG21 ' A' ' 686' ' ' ILE . 3.2 mp -60.27 -38.55 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 119.79 -0.764 . . . . 0.0 109.956 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.77 -41.91 83.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 688' ' ' ILE . . . . . 0.568 ' H ' HD12 ' B' ' 688' ' ' ILE . 3.8 mp -66.69 -42.19 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.461 ' O ' HG12 ' B' ' 689' ' ' VAL . 66.1 t -68.52 -1.78 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.202 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.151 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -91.75 -45.57 3.92 Favored Glycine 0 C--N 1.35 1.343 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 27.3 m -53.52 -30.13 39.96 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.121 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 8.4 mp -61.71 -36.3 80.52 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.034 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.747 HG21 HD23 ' C' ' 692' ' ' LEU . 0.3 OUTLIER -59.27 -33.37 50.66 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 120.164 -0.614 . . . . 0.0 110.756 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -70.03 -36.46 72.63 Favored Glycine 0 CA--C 1.534 1.241 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 179.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.54 ' O ' HG22 ' B' ' 698' ' ' VAL . 1.0 OUTLIER -56.14 -31.6 63.49 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.426 -178.85 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.16 -31.56 13.89 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.602 HD11 ' NH2' ' C' ' 696' ' ' ARG . 48.7 mm -59.91 -48.29 88.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.427 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.54 HG22 ' O ' ' B' ' 695' ' ' LEU . 16.1 m -66.75 -28.36 42.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.752 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -55.49 -26.82 44.77 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.623 -179.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.6 -40.68 79.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.459 -0.496 . . . . 0.0 109.875 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 63.0 t -64.49 -42.62 95.76 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.11 -38.64 89.66 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.472 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 68.1 m -57.91 -34.54 69.95 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.963 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.8 tp -66.1 -42.1 89.7 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.995 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.69 -17.43 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.915 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -60.96 -26.2 67.37 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.465 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -73.79 -36.45 65.04 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.851 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 43.0 t -82.91 -36.13 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.273 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 66.3 mtm180 -144.01 130.92 20.39 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.709 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 C--O 1.22 -0.479 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.648 -179.97 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 3.1 tt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 28.3 mt -136.27 132.04 35.22 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -170.6 -176.51 2.12 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.099 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.467 HD12 ' O ' ' A' ' 661' ' ' LEU . 8.1 tt -52.45 -31.39 34.47 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.371 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -71.21 -40.35 71.2 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.707 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.7 mmtt -70.22 -43.51 70.5 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.169 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -60.24 -44.67 95.03 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.96 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.63 -41.04 88.93 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.534 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 20.1 m -56.58 -31.94 64.73 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.269 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 9.2 tp -70.48 -4.72 24.15 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -72.71 -13.77 61.41 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -178.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -62.77 -50.42 71.12 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 118.291 -1.364 . . . . 0.0 110.593 -178.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 672' ' ' TRP . . . . . 0.415 ' O ' ' N ' ' C' ' 674' ' ' ASP . 0.3 OUTLIER -101.75 -23.35 14.22 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 178.881 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 49.0 p90 42.01 9.19 0.0 OUTLIER 'General case' 0 C--N 1.362 1.128 0 N-CA-C 116.408 2.003 . . . . 0.0 116.408 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 674' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' C' ' 672' ' ' TRP . 30.2 t70 -64.22 -53.97 40.9 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 120.156 1.344 . . . . 0.0 110.662 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 9.3 tp -69.88 -29.67 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.454 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 17.3 m -58.45 -40.02 81.5 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.504 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.43 -46.31 90.5 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 119.964 -0.694 . . . . 0.0 109.564 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.482 ' O ' HG22 ' C' ' 682' ' ' ILE . 28.3 t90 -56.84 -39.09 73.6 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.259 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.01 -2.87 42.31 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -179.401 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 4.7 t90 -146.83 44.06 1.17 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 119.772 -0.771 . . . . 0.0 112.325 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -161.18 -42.32 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.725 ' O ' HD13 ' C' ' 682' ' ' ILE . 0.1 OUTLIER -55.88 -36.91 45.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.49 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 3.5 ptt-85 -55.81 -40.73 73.16 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 40.5 mm -59.85 -41.3 85.3 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.49 ' HA ' HD13 ' C' ' 688' ' ' ILE . 1.3 t80 -67.09 -27.77 67.63 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.807 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.685 ' CG2' HD11 ' A' ' 686' ' ' ILE . 1.1 tp -57.89 -43.6 84.83 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.727 -177.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 39.2 mt -59.27 -41.64 84.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.027 -179.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.591 ' H ' HD12 ' C' ' 688' ' ' ILE . 3.4 mp -56.82 -41.5 75.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 52.4 t -67.67 -31.38 52.2 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.126 0 CA-C-O 118.684 -0.674 . . . . 0.0 112.197 -177.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -62.74 -53.48 40.83 Favored Glycine 0 CA--C 1.538 1.491 0 CA-C-N 119.415 1.007 . . . . 0.0 111.632 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.5 m -61.83 -24.39 66.86 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 117.231 0.515 . . . . 0.0 112.377 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 692' ' ' LEU . . . . . 0.747 HD23 HG21 ' B' ' 693' ' ' ILE . 2.5 tp -54.22 -32.63 56.36 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.711 -178.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.636 HD11 HD23 ' A' ' 692' ' ' LEU . 2.3 pp -70.19 -28.07 34.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 120.259 -0.576 . . . . 0.0 111.134 -178.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.71 -55.27 23.57 Favored Glycine 0 CA--C 1.542 1.778 0 C-N-CA 121.182 -0.532 . . . . 0.0 113.125 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.3 tt -58.42 -36.45 73.63 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.602 ' NH2' HD11 ' B' ' 697' ' ' ILE . 0.3 OUTLIER -50.56 -35.85 31.78 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -178.725 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.62 ' O ' HD13 ' C' ' 697' ' ' ILE . 0.2 OUTLIER -59.18 -41.02 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.18 -178.177 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.772 ' O ' HG12 ' C' ' 701' ' ' VAL . 64.9 t -56.49 -29.0 27.91 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.827 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -56.05 -35.25 66.7 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.35 -34.93 64.69 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.103 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 701' ' ' VAL . . . . . 0.772 HG12 ' O ' ' C' ' 698' ' ' VAL . 9.3 p -59.06 -31.53 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.5 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.59 -30.54 67.27 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.391 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.3 t -57.93 -39.0 76.95 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.849 -0.341 . . . . 0.0 110.428 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 16.3 tp -56.51 -31.21 63.87 Favored 'General case' 0 C--O 1.218 -0.588 0 C-N-CA 120.635 -0.426 . . . . 0.0 109.871 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.8 t -75.66 -17.57 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.042 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -60.66 -22.36 63.77 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.18 -3.7 58.9 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 120.625 -0.43 . . . . 0.0 112.018 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 48.3 t -104.41 -36.03 3.77 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.534 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.319 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 -123.94 176.61 6.22 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.959 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 118.369 -0.824 . . . . 0.0 112.3 -179.806 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.513 HD23 ' N ' ' A' ' 660' ' ' LEU . 1.4 pt? . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 9.5 mp -99.72 155.38 17.66 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.252 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -163.51 159.78 22.42 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.758 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 8.9 tt -61.83 -40.53 95.61 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.775 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -72.68 -23.91 60.94 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.478 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -64.41 -40.0 94.93 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.914 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -70.25 -49.61 48.14 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.148 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.81 -31.38 72.32 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.48 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 1.8 m -57.43 -31.59 66.05 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.112 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 70.4 mt -71.27 -4.83 27.97 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -68.98 -1.0 6.37 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -62.32 -49.17 76.69 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 118.41 -1.316 . . . . 0.0 111.887 -176.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -104.23 -11.04 17.46 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.832 177.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.3 p90 43.33 18.84 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -64.42 -52.93 55.61 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.507 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.547 HD11 ' CE3' ' A' ' 678' ' ' TRP . 7.1 tp -68.84 -28.35 39.41 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.316 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 75.7 p -58.9 -40.35 84.2 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 119.818 -0.753 . . . . 0.0 109.386 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -65.33 -33.83 76.9 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.807 178.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.638 ' CD1' HG21 ' A' ' 682' ' ' ILE . 42.3 t90 -69.83 -44.56 69.72 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.868 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.68 -2.6 7.17 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.222 -178.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -136.48 -58.43 0.74 Allowed 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 119.723 -0.791 . . . . 0.0 112.874 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -72.52 -41.44 65.88 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 120.482 -0.487 . . . . 0.0 112.258 -177.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.638 HG21 ' CD1' ' A' ' 678' ' ' TRP . 28.9 mm -67.26 -36.44 76.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -55.29 -48.03 74.68 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.185 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.91 -43.14 91.52 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 C-N-CA 120.991 -0.283 . . . . 0.0 111.178 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.425 ' HA ' HD13 ' A' ' 688' ' ' ILE . 3.2 t80 -52.57 -28.71 22.1 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -177.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.53 HG12 HG21 ' C' ' 686' ' ' ILE . 1.4 mp -57.95 -37.83 63.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 CA-C-O 119.188 -0.434 . . . . 0.0 111.18 -179.11 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.11 -41.95 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.077 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 688' ' ' ILE . . . . . 0.581 HD12 ' H ' ' A' ' 688' ' ' ILE . 5.1 mp -64.56 -40.97 90.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.765 ' O ' HD11 ' A' ' 692' ' ' LEU . 21.9 t -68.32 4.38 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -178.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -110.71 -5.77 27.29 Favored Glycine 0 CA--C 1.543 1.828 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 178.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 54.2 m -88.24 -32.84 18.33 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 117.141 0.471 . . . . 0.0 111.343 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.765 HD11 ' O ' ' A' ' 689' ' ' VAL . 0.2 OUTLIER -53.67 -32.6 52.29 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.089 -178.237 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.734 HD13 ' O ' ' A' ' 693' ' ' ILE . 0.1 OUTLIER -54.82 -34.18 29.98 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 120.3 -0.56 . . . . 0.0 109.898 179.692 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.42 -43.82 36.22 Favored Glycine 0 C--N 1.346 1.117 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 177.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.437 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.4 OUTLIER -56.43 -37.43 70.2 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.151 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -50.68 -35.37 30.58 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 122.776 0.431 . . . . 0.0 111.152 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 75.2 mt -59.31 -41.97 85.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 CA-C-O 118.994 -0.527 . . . . 0.0 111.214 -176.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.437 HG12 ' O ' ' A' ' 695' ' ' LEU . 2.4 p -67.6 -28.49 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 118.956 0.798 . . . . 0.0 111.074 179.285 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -55.06 -35.01 64.06 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.461 0.172 . . . . 0.0 110.642 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.42 -35.49 65.44 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.895 -178.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 698' ' ' VAL . 0.5 OUTLIER -60.59 -38.23 77.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.758 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 702' ' ' LEU . . . . . 0.427 ' O ' HG22 ' A' ' 705' ' ' VAL . 0.0 OUTLIER -61.62 -29.07 69.81 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.755 -179.847 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 4.0 t -63.62 -31.91 73.22 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.101 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 30.6 tp -62.73 -39.52 94.35 Favored 'General case' 0 C--O 1.218 -0.588 0 O-C-N 123.102 0.251 . . . . 0.0 111.085 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 705' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 702' ' ' LEU . 35.1 m -82.65 -10.8 12.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -63.81 -24.06 67.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 120.725 -0.39 . . . . 0.0 112.027 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 12.6 ptt-85 -76.6 -19.13 58.18 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 120.378 -0.529 . . . . 0.0 112.305 -179.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 6.7 m -104.99 26.05 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 55.2 mtm180 -86.53 152.95 22.2 Favored 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.572 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.068 -0.967 . . . . 0.0 110.917 -179.908 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.411 ' O ' HD12 ' B' ' 660' ' ' LEU . 3.6 pp . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.513 HD22 ' CZ2' ' B' ' 666' ' ' TRP . 70.2 mt -124.65 154.61 40.48 Favored 'General case' 0 C--O 1.22 -0.479 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.101 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -147.83 145.87 28.89 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.783 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.43 ' O ' HD23 ' B' ' 663' ' ' LEU . 4.6 tt -54.95 -40.01 69.52 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 121.016 0.436 . . . . 0.0 110.325 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.57 -35.46 77.43 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.701 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -68.14 -43.04 79.21 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.45 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 666' ' ' TRP . . . . . 0.513 ' CZ2' HD22 ' B' ' 661' ' ' LEU . 83.3 m95 -59.75 -48.71 80.59 Favored 'General case' 0 C--O 1.22 -0.449 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.374 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -54.23 -33.03 57.47 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.757 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.51 -32.97 69.32 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.098 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.789 HD11 HG23 ' B' ' 675' ' ' ILE . 49.0 tp -59.53 -17.34 31.43 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.712 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -68.64 -17.07 64.03 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -89.46 -16.65 30.34 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -86.49 -22.66 26.3 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.32 -177.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 41.0 t80 59.87 -73.06 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -51.44 -53.01 41.37 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -176.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.789 HG23 HD11 ' B' ' 669' ' ' LEU . 5.0 tp -68.27 -27.93 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 119.829 -0.749 . . . . 0.0 110.777 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.3 m -63.25 -48.28 78.88 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.589 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -71.24 -41.36 70.23 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.785 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.571 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.5 t90 -62.81 -44.22 96.74 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.331 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 679' ' ' LEU . . . . . 0.453 HD13 HD11 ' B' ' 675' ' ' ILE . 0.5 OUTLIER -75.78 -27.51 58.04 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.557 -178.126 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.6 t90 -91.89 0.02 57.49 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -119.0 -6.28 10.5 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.626 -0.43 . . . . 0.0 112.092 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.571 HG23 ' O ' ' B' ' 678' ' ' TRP . 7.8 pt -63.44 -42.65 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.669 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -43.95 77.01 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.769 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 56.8 mt -66.65 -37.74 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 178.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -55.8 -29.97 60.59 Favored 'General case' 0 C--O 1.218 -0.601 0 C-N-CA 121.112 -0.235 . . . . 0.0 111.47 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.599 HG21 HG13 ' C' ' 686' ' ' ILE . 27.2 mm -60.02 -41.84 87.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.45 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.82 -41.82 83.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 688' ' ' ILE . . . . . 0.516 ' N ' HD12 ' B' ' 688' ' ' ILE . 2.8 mp -61.93 -42.33 94.31 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.463 ' O ' HG12 ' B' ' 689' ' ' VAL . 60.0 t -68.64 -2.14 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.237 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 690' ' ' GLY . . . . . 0.49 ' O ' HG22 ' B' ' 693' ' ' ILE . . . -86.33 -55.83 2.4 Favored Glycine 0 C--N 1.351 1.368 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 21.9 m -58.08 -30.79 66.5 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.741 179.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.3 tp -54.71 -34.35 62.26 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.772 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.679 HD11 ' HG3' ' C' ' 696' ' ' ARG . 0.3 OUTLIER -73.91 -27.76 23.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 120.349 -0.541 . . . . 0.0 111.321 -179.334 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.86 -41.65 87.85 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.53 -31.79 64.48 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 121.249 -0.18 . . . . 0.0 111.021 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.98 -30.94 16.39 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 58.9 mt -59.44 -41.53 84.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.085 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 47.4 t -65.28 -28.59 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.496 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.47 -26.66 43.69 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.035 -179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -51.37 -37.04 46.01 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.735 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.27 -42.42 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.547 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.53 -29.09 69.78 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.035 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 20.9 t -57.98 -32.35 67.79 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.609 -0.437 . . . . 0.0 111.279 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 26.1 tp -66.08 -40.94 91.22 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.241 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -64.63 -25.62 38.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.788 0 C-N-CA 120.726 -0.389 . . . . 0.0 110.17 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -67.27 -13.07 61.64 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.433 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.26 -31.74 13.33 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 120.396 0.141 . . . . 0.0 110.671 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.539 ' O ' HG12 ' B' ' 708' ' ' VAL . 20.4 t -87.79 25.96 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.398 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -50.61 117.89 2.73 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 122.148 -0.345 . . . . 0.0 111.29 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.369 -179.998 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.51 ' O ' HD12 ' C' ' 661' ' ' LEU . 4.2 pp -162.58 151.25 14.75 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 120.807 0.337 . . . . 0.0 111.219 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -171.26 179.25 3.04 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.903 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.11 -30.99 71.4 Favored 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.449 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.49 -36.44 78.93 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.651 -0.419 . . . . 0.0 110.845 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 59.1 mmtt -70.43 -42.37 71.66 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.369 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -70.4 -53.99 14.25 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.62 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.58 -37.51 75.93 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.4 t -62.83 -33.46 75.28 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.844 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.581 HD21 HG23 ' C' ' 675' ' ' ILE . 19.9 tp -70.99 -5.28 29.95 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -68.58 -6.11 23.68 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -79.9 -49.64 11.62 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 119.567 -0.853 . . . . 0.0 113.269 -178.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -89.94 -23.77 21.48 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 114.738 1.384 . . . . 0.0 114.738 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 55.17 -10.26 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 178.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -63.9 -54.53 33.28 Favored 'General case' 0 C--N 1.352 0.715 0 CA-C-N 120.465 1.484 . . . . 0.0 112.381 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.581 HG23 HD21 ' C' ' 669' ' ' LEU . 7.9 tp -70.14 -32.81 52.31 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.962 178.197 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -58.77 -39.07 79.93 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.916 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -59.73 -47.51 85.36 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 120.365 -0.534 . . . . 0.0 109.692 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 19.5 t90 -72.61 -28.27 62.67 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.132 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.419 HD23 HG13 ' C' ' 675' ' ' ILE . 0.2 OUTLIER -67.45 -4.05 10.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.521 -179.113 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -142.48 -179.09 6.09 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 64.58 -11.3 0.13 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.01 -37.07 59.18 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 CA-C-N 119.444 1.02 . . . . 0.0 110.5 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 41.0 mtt85 -60.71 -48.3 82.41 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.886 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.537 ' O ' HD12 ' C' ' 688' ' ' ILE . 97.4 mt -62.7 -44.07 99.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.725 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.434 ' HA ' HD13 ' C' ' 688' ' ' ILE . 0.1 OUTLIER -63.76 -28.53 69.94 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.484 0.49 . . . . 0.0 110.154 178.915 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.599 HG13 HG21 ' B' ' 686' ' ' ILE . 0.9 OUTLIER -58.64 -38.77 73.34 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.832 -178.659 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 45.7 mt -67.11 -42.92 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.268 -178.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.537 HD12 ' O ' ' C' ' 684' ' ' ILE . 4.0 mp -57.97 -41.06 79.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-O 119.477 -0.297 . . . . 0.0 111.772 -178.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.598 ' O ' HD11 ' C' ' 692' ' ' LEU . 38.3 t -67.56 -20.06 25.91 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -176.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -90.77 14.38 63.28 Favored Glycine 0 CA--C 1.545 1.942 0 CA-C-N 119.994 1.27 . . . . 0.0 113.409 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.6 m -88.68 -34.25 17.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.365 1.083 . . . . 0.0 112.418 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 692' ' ' LEU . . . . . 0.598 HD11 ' O ' ' C' ' 689' ' ' VAL . 0.2 OUTLIER -61.16 -33.09 72.86 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.982 -178.369 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.525 ' H ' HD12 ' C' ' 692' ' ' LEU . 2.1 pp -57.81 -40.05 74.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 119.794 -0.762 . . . . 0.0 110.267 -178.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.9 -53.36 46.98 Favored Glycine 0 CA--C 1.539 1.593 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 7.7 tt -56.63 -31.6 64.49 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.679 ' HG3' HD11 ' B' ' 693' ' ' ILE . 23.6 mmt180 -50.55 -36.52 34.83 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 -178.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.63 ' O ' HD13 ' C' ' 697' ' ' ILE . 0.2 OUTLIER -59.67 -41.64 85.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.582 -177.615 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.6 -28.87 45.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.64 -35.16 73.84 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.667 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.3 -35.41 65.06 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.148 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 80.4 t -59.54 -31.41 46.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.029 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.4 tp -58.34 -34.29 70.47 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.418 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 29.2 p -58.0 -37.61 74.6 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.561 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.8 tp -57.59 -39.9 77.84 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.671 -0.411 . . . . 0.0 109.946 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 28.9 t -72.82 -31.43 36.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.702 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -60.92 -8.82 3.43 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -109.65 -32.84 6.96 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 39.8 t -82.94 -29.13 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.835 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 -130.92 122.43 26.94 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.042 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 . . . . . 0 C--O 1.221 -0.431 0 CA-C-O 118.136 -0.935 . . . . 0.0 110.944 179.994 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.511 ' N ' HD22 ' A' ' 660' ' ' LEU . 3.6 mm? . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.679 ' O ' HD23 ' C' ' 663' ' ' LEU . 44.4 mt 60.23 115.31 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.144 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -165.65 168.5 16.21 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.208 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.522 HD23 ' O ' ' A' ' 663' ' ' LEU . 5.3 tt -52.52 -38.82 60.47 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.823 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.15 -34.62 68.65 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.518 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -68.18 -44.32 76.16 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.356 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -58.7 -44.1 90.24 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-O 120.815 0.34 . . . . 0.0 110.942 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 667' ' ' ALA . . . . . 0.462 ' CB ' HD22 ' B' ' 660' ' ' LEU . . . -51.68 -19.66 1.69 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.142 -178.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 32.1 t -64.69 -32.65 74.42 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.421 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 669' ' ' LEU . 4.2 mm? -69.82 -20.49 63.44 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -68.89 -17.22 63.94 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.905 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -63.24 -35.49 80.52 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -179.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 3.9 m95 -94.84 -23.44 17.48 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 119.76 -0.776 . . . . 0.0 111.099 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 18.5 t80 66.8 -41.74 0.4 Allowed 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 178.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -52.09 64.32 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -177.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.474 HD11 ' CE3' ' A' ' 678' ' ' TRP . 8.1 tp -62.92 -29.91 48.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.719 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.177 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.4 m -59.69 -37.57 79.16 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.835 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -66.27 -23.16 66.35 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.503 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.474 ' CE3' HD11 ' A' ' 675' ' ' ILE . 4.9 t90 -72.05 -46.4 57.14 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.225 -179.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.11 -24.45 19.12 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -177.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -74.07 -0.59 16.96 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 119.397 -0.921 . . . . 0.0 111.607 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -128.31 -25.07 3.01 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.617 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.4 tt -55.56 -36.6 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.874 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 26.9 ttp-105 -55.84 -48.42 75.52 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 29.3 mt -64.89 -45.97 93.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -52.83 -33.22 48.39 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.9 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.485 HG13 HG21 ' C' ' 686' ' ' ILE . 1.1 mp -58.4 -42.81 85.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 3.7 mm -58.44 -42.14 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 119.907 -0.717 . . . . 0.0 109.564 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 41.8 mm -57.08 -41.01 76.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-N 116.965 -0.107 . . . . 0.0 110.958 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.488 ' O ' HG12 ' A' ' 689' ' ' VAL . 42.8 t -67.75 -0.09 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 C-N-CA 120.158 -0.617 . . . . 0.0 111.495 -178.134 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.97 -40.23 8.18 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 177.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 4.3 m -77.86 -16.92 57.91 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.461 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.5 tp -58.83 -44.04 90.8 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.171 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.729 HD13 ' O ' ' A' ' 693' ' ' ILE . 0.2 OUTLIER -63.0 -30.48 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.231 179.43 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.55 -37.82 78.34 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.335 -1.506 . . . . 0.0 109.335 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.641 ' O ' HG22 ' A' ' 698' ' ' VAL . 0.4 OUTLIER -56.57 -35.97 68.78 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 120.572 0.225 . . . . 0.0 110.752 179.172 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.645 ' HG2' HD11 ' C' ' 693' ' ' ILE . 0.0 OUTLIER -50.55 -33.89 23.48 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 123.249 0.62 . . . . 0.0 111.479 178.308 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 77.3 mt -57.8 -40.08 74.13 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.457 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 695' ' ' LEU . 16.8 m -55.62 -28.21 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 119.227 0.921 . . . . 0.0 110.77 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.451 ' HA ' ' HB3' ' A' ' 702' ' ' LEU . 28.9 m-85 -55.45 -36.43 66.53 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.58 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.77 -48.02 78.83 Favored 'General case' 0 C--O 1.219 -0.553 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.92 -43.78 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 702' ' ' LEU . . . . . 0.451 ' HB3' ' HA ' ' A' ' 699' ' ' PHE . 0.6 OUTLIER -58.88 -24.81 62.72 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.729 178.629 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.7 -43.16 94.22 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.376 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.0 tp -65.27 -36.71 84.93 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-O 121.085 0.469 . . . . 0.0 110.062 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.61 -36.1 68.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.052 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.88 -8.74 3.34 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.888 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.95 -45.64 49.03 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 120.594 0.235 . . . . 0.0 111.038 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 708' ' ' VAL . 6.9 t -98.78 26.49 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.563 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -36.16 146.26 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 . . . . . 0 C--O 1.219 -0.528 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.164 -179.245 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.477 ' HB2' HD21 ' A' ' 663' ' ' LEU . 39.6 mt . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 49.47 -152.04 0.15 Allowed 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 662' ' ' GLU . . . . . 0.4 ' HB2' ' HB2' ' B' ' 665' ' ' LYS . 9.8 pt-20 -170.49 65.7 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.32 0.509 . . . . 0.0 111.272 -178.077 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.614 ' O ' HD23 ' B' ' 663' ' ' LEU . 5.8 tt -66.88 -41.11 87.76 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 119.981 -0.688 . . . . 0.0 111.974 -179.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -74.58 -29.28 61.27 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.092 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 665' ' ' LYS . . . . . 0.4 ' HB2' ' HB2' ' B' ' 662' ' ' GLU . 1.1 tptm -70.46 -25.46 63.19 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 118.889 -0.577 . . . . 0.0 111.917 -178.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 666' ' ' TRP . . . . . 0.727 ' CG ' HD12 ' C' ' 661' ' ' LEU . 91.9 m95 -58.91 -50.7 73.05 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 119.051 -1.059 . . . . 0.0 108.435 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.65 -41.89 95.8 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.996 -178.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 37.9 m -65.85 -31.74 72.87 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.52 -0.472 . . . . 0.0 109.911 178.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 29.8 mt -72.46 -4.98 33.61 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.155 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -68.41 -3.0 9.74 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.574 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 29.6 m-20 -89.38 -12.71 39.6 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -178.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -88.92 -22.75 22.95 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.716 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 60.0 -72.38 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -51.74 -52.31 49.63 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.511 HD13 ' O ' ' B' ' 675' ' ' ILE . 0.3 OUTLIER -68.27 -31.12 50.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 119.571 -0.852 . . . . 0.0 110.569 -179.31 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.9 m -58.74 -43.21 90.17 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -60.96 -37.83 83.77 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.108 178.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -71.63 -42.08 68.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.045 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.13 -6.57 18.2 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 119.367 -0.933 . . . . 0.0 111.114 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 680' ' ' TRP . . . . . 0.409 ' O ' ' HB2' ' B' ' 681' ' ' TYR . 1.9 t90 -129.61 176.4 8.02 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 177.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 681' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' B' ' 680' ' ' TRP . 96.7 m-85 72.36 -19.48 0.29 Allowed 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 27.2 pt -55.76 -37.05 45.37 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 CA-C-N 118.169 0.44 . . . . 0.0 110.453 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -45.65 91.26 Favored 'General case' 0 C--O 1.219 -0.541 0 O-C-N 123.102 0.251 . . . . 0.0 110.408 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 38.1 mt -67.15 -38.08 80.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.43 -28.87 60.73 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.514 -178.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.89 HG21 HD12 ' C' ' 686' ' ' ILE . 22.4 mm -63.8 -41.06 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.842 -178.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 687' ' ' ILE . . . . . 0.546 ' H ' HD12 ' B' ' 687' ' ' ILE . 3.6 mp -58.82 -42.16 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 688' ' ' ILE . . . . . 0.604 ' H ' HD12 ' B' ' 688' ' ' ILE . 4.0 mp -62.82 -43.11 98.59 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.46 ' O ' HG12 ' B' ' 689' ' ' VAL . 97.0 t -68.55 -1.93 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.181 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.099 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -89.79 -61.47 1.36 Allowed Glycine 0 C--N 1.349 1.296 0 N-CA-C 110.619 -0.993 . . . . 0.0 110.619 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 2.9 m -53.22 -20.81 4.43 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.127 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.434 HD23 HG21 ' A' ' 693' ' ' ILE . 1.0 OUTLIER -55.21 -32.58 62.37 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 121.247 -0.181 . . . . 0.0 110.841 -179.694 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.437 HG21 ' HB ' ' C' ' 693' ' ' ILE . 2.4 pp -68.5 -38.3 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.075 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 694' ' ' GLY . . . . . 0.691 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -65.58 -45.07 91.45 Favored Glycine 0 C--O 1.213 -1.195 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.706 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.87 -39.35 74.17 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -50.55 -31.41 15.61 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.691 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.9 tp -59.69 -41.58 85.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 C-N-CA 119.776 -0.77 . . . . 0.0 111.619 -177.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.406 ' O ' HG22 ' B' ' 701' ' ' VAL . 84.1 t -58.99 -28.31 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 121.289 -0.164 . . . . 0.0 111.019 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -24.87 36.62 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.22 -35.08 16.42 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 119.173 -0.441 . . . . 0.0 112.154 -177.469 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 701' ' ' VAL . . . . . 0.406 HG22 ' O ' ' B' ' 698' ' ' VAL . 34.8 m -59.24 -36.04 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.029 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.9 tt -68.52 -40.18 80.88 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 31.1 p -59.73 -31.94 70.08 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.711 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 704' ' ' LEU . . . . . 0.458 ' O ' HD13 ' B' ' 704' ' ' LEU . 0.2 OUTLIER -61.01 -25.59 67.01 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 120.662 -0.415 . . . . 0.0 109.973 179.294 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 59.1 t -90.22 -10.75 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.952 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -65.32 -10.74 35.24 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -73.98 -39.23 63.82 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 119.817 -0.753 . . . . 0.0 110.82 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.466 ' O ' HG12 ' B' ' 708' ' ' VAL . 29.9 t -91.3 -4.42 10.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.342 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 75.8 ttt-85 -57.47 132.97 54.75 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.46 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.888 -179.964 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 119.444 -0.313 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.727 HD12 ' CG ' ' B' ' 666' ' ' TRP . 0.5 OUTLIER -67.84 -84.84 0.02 OUTLIER 'General case' 0 C--N 1.348 0.543 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.54 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 662' ' ' GLU . . . . . 0.425 ' HG3' HD22 ' C' ' 661' ' ' LEU . 0.0 OUTLIER -175.68 72.45 0.02 OUTLIER 'General case' 0 C--N 1.354 0.773 0 CA-C-N 118.805 0.729 . . . . 0.0 112.283 -179.669 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.774 HD22 ' O ' ' C' ' 663' ' ' LEU . 0.0 OUTLIER -65.29 -40.07 93.35 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.057 179.077 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 664' ' ' ASP . . . . . 0.763 ' N ' HD13 ' C' ' 663' ' ' LEU . 22.5 t0 -74.37 -29.74 61.68 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -70.57 -29.36 65.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.452 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 37.5 m95 -58.52 -49.61 76.75 Favored 'General case' 0 C--O 1.22 -0.447 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.39 90.86 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.527 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 6.0 m -62.34 -31.02 71.6 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.661 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.472 ' HG ' HG23 ' C' ' 675' ' ' ILE . 9.7 tp -55.36 -16.64 3.74 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.379 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 26.2 m95 -68.66 -15.44 63.52 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.291 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -62.59 -42.75 99.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.149 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.4 m95 -79.93 -22.38 42.77 Favored 'General case' 0 CA--C 1.552 1.048 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 15.5 t80 70.22 -51.94 0.65 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.982 1.265 . . . . 0.0 112.711 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -52.44 63.0 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.472 HG23 ' HG ' ' C' ' 669' ' ' LEU . 6.4 tp -68.44 -30.97 49.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.393 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 94.4 m -63.41 -50.28 70.43 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.844 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -68.6 -44.16 74.9 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 123.354 0.409 . . . . 0.0 110.951 -179.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.425 ' CE3' HD12 ' C' ' 675' ' ' ILE . 10.2 t90 -61.39 -43.56 98.66 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.937 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.577 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.3 OUTLIER -78.92 -33.18 45.72 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.215 -179.22 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 21.9 t90 -59.61 -37.43 78.57 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.97 -178.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 681' ' ' TYR . . . . . 0.767 ' HB2' HD12 ' C' ' 684' ' ' ILE . 2.3 p90 -123.93 29.93 6.32 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 119.973 -0.691 . . . . 0.0 112.334 -178.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.407 HD13 ' NE1' ' C' ' 678' ' ' TRP . 7.1 tp -55.77 -37.03 45.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.66 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.859 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.0 -34.66 78.5 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.239 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.767 HD12 ' HB2' ' C' ' 681' ' ' TYR . 95.0 mt -62.5 -46.22 96.92 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.556 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.623 ' HA ' HD12 ' C' ' 688' ' ' ILE . 2.3 m-85 -57.99 -29.54 65.34 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.381 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.89 HD12 HG21 ' B' ' 686' ' ' ILE . 21.8 mm -64.01 -44.1 97.76 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.985 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.9 mt -58.96 -41.41 83.03 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.623 HD12 ' HA ' ' C' ' 685' ' ' PHE . 73.9 mt -56.58 -41.53 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 58.7 t -67.63 -31.5 52.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.042 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.19 -38.67 87.47 Favored Glycine 0 C--N 1.353 1.518 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 178.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 10.7 m -78.28 -24.33 46.83 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 117.139 0.47 . . . . 0.0 111.183 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.48 -43.58 96.87 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.217 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.645 HD11 ' HG2' ' A' ' 696' ' ' ARG . 0.6 OUTLIER -61.96 -38.21 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.156 179.768 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.73 -36.4 89.63 Favored Glycine 0 CA--C 1.544 1.884 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.315 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.487 HD23 ' O ' ' C' ' 695' ' ' LEU . 1.7 tt -55.99 -31.16 62.78 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 117.049 0.425 . . . . 0.0 111.87 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -49.98 -34.76 22.01 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 9.0 tp -58.24 -40.88 79.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.2 p -56.12 -28.93 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 119.551 1.068 . . . . 0.0 110.992 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.58 -35.08 79.77 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.634 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.09 -35.78 64.96 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.522 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 69.9 t -60.0 -31.95 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.118 178.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.87 -30.69 67.93 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.867 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 15.4 m -58.24 -40.49 81.9 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.246 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 16.3 tp -55.95 -26.8 49.63 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.622 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 20.4 t -81.59 -24.65 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.372 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -60.57 -20.83 61.63 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.05 -42.66 59.88 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 120.742 0.305 . . . . 0.0 110.558 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 708' ' ' VAL . . . . . 0.501 ' O ' HG12 ' C' ' 708' ' ' VAL . 20.4 t -97.32 2.23 10.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.372 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? 56.64 172.51 0.04 OUTLIER 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.628 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.81 -179.862 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . 0.418 ' C19' HD11 ' A' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . 0.616 ' C7 ' HD11 ' C' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 2.2 mm? . . . . . 0 N--CA 1.489 1.506 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.836 HD13 ' NE1' ' C' ' 666' ' ' TRP . 7.2 tt 55.4 104.23 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.954 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -139.97 161.38 37.74 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.39 179.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.833 HD13 ' H ' ' A' ' 664' ' ' ASP . 0.0 OUTLIER -62.26 -37.76 86.68 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.128 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 664' ' ' ASP . . . . . 0.833 ' H ' HD13 ' A' ' 663' ' ' LEU . 37.3 m-20 -74.84 -26.47 59.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.595 178.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.07 -46.07 85.94 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -65.17 -48.27 74.08 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.052 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.32 -28.67 59.65 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.756 -179.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.3 t -62.15 -31.91 72.45 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.165 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.9 mp -72.28 -14.26 61.71 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -68.61 -25.07 64.67 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.608 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 37.9 t-20 -62.55 -36.42 82.58 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.5 m95 -83.36 -22.89 32.69 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.334 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 67.89 -40.13 0.41 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -62.04 -52.34 64.32 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.475 HD12 ' CE3' ' A' ' 678' ' ' TRP . 7.1 tp -68.16 -38.47 79.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 119.872 -0.731 . . . . 0.0 111.048 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -61.87 -44.43 96.84 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 119.933 -0.707 . . . . 0.0 109.579 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -65.52 -37.68 87.45 Favored 'General case' 0 C--O 1.214 -0.787 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.207 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.475 ' CE3' HD12 ' A' ' 675' ' ' ILE . 7.5 t90 -70.72 -34.5 71.98 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.47 HD23 HG13 ' A' ' 675' ' ' ILE . 1.4 mm? -67.64 -3.42 8.96 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 120.468 -0.493 . . . . 0.0 111.456 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.98 150.69 49.35 Favored 'General case' 0 C--O 1.211 -0.966 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.23 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 84.08 -23.0 0.19 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.453 0.701 . . . . 0.0 110.473 -178.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.471 HD13 ' HD1' ' A' ' 678' ' ' TRP . 1.4 tp -67.62 -42.93 87.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 21.2 ttp-105 -60.59 -48.07 83.38 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.468 ' HA ' HD12 ' A' ' 687' ' ' ILE . 1.5 mp -59.83 -38.03 74.36 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.13 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.425 ' HA ' HD12 ' A' ' 688' ' ' ILE . 9.0 t80 -52.7 -43.28 65.51 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.527 -178.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.406 ' N ' HD12 ' A' ' 686' ' ' ILE . 1.8 mp -58.29 -37.89 65.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.9 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 687' ' ' ILE . . . . . 0.468 HD12 ' HA ' ' A' ' 684' ' ' ILE . 81.2 mt -58.17 -43.8 86.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 688' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 685' ' ' PHE . 61.2 mt -58.32 -41.43 81.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 177.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.466 ' O ' HG12 ' A' ' 689' ' ' VAL . 43.5 t -67.74 -3.09 2.06 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.348 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -86.29 -53.83 2.86 Favored Glycine 0 C--N 1.349 1.277 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 178.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 15.9 m -61.36 -20.62 63.21 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.735 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.7 tp -54.04 -46.91 72.03 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.593 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.418 HG21 ' HB ' ' B' ' 693' ' ' ILE . 2.1 pp -55.97 -41.21 66.89 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.867 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.84 -51.62 52.11 Favored Glycine 0 C--O 1.214 -1.098 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.572 ' O ' HG12 ' A' ' 698' ' ' VAL . 1.2 tt -60.08 -34.23 73.16 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.993 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.519 ' NE ' HD13 ' C' ' 697' ' ' ILE . 37.9 mmt180 -65.35 -36.41 83.94 Favored 'General case' 0 C--O 1.214 -0.786 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -178.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 4.9 pt -58.98 -40.41 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 CA-C-N 119.708 1.14 . . . . 0.0 112.352 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.824 ' O ' HG22 ' A' ' 701' ' ' VAL . 5.2 p -55.59 -26.79 20.32 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.915 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.33 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -54.27 -33.88 59.62 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.28 -35.53 62.67 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 119.042 -0.504 . . . . 0.0 111.968 -176.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.824 HG22 ' O ' ' A' ' 698' ' ' VAL . 32.9 m -61.09 -31.92 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.481 178.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -24.39 63.93 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.551 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 33.9 m -57.45 -43.11 83.66 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.919 -178.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.2 tp -70.24 -36.45 74.49 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.122 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 56.9 t -60.68 -35.7 65.74 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.568 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -60.94 -21.29 63.28 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.662 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.42 ' HD3' HD21 ' C' ' 704' ' ' LEU . 45.1 mtp85 -101.92 -22.5 14.31 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.435 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.522 HG12 ' O ' ' A' ' 708' ' ' VAL . 17.0 t -108.67 26.15 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.552 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.42 -23.85 52.01 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.474 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.706 -179.917 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.529 HD12 HD23 ' A' ' 663' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.234 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 65.6 mt -137.47 124.3 21.25 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.498 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -151.26 176.51 11.15 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.581 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.604 ' C ' HD22 ' B' ' 663' ' ' LEU . 0.0 OUTLIER -52.19 -18.19 1.4 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.945 179.846 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 664' ' ' ASP . . . . . 0.458 ' N ' HD22 ' B' ' 663' ' ' LEU . 2.2 m-20 -74.51 -47.97 29.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.243 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -70.24 -38.59 75.21 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.101 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 71.8 m95 -64.96 -37.12 86.61 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.015 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.86 -46.0 88.81 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.171 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 1.9 t -59.76 -31.75 69.94 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.068 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.37 -26.36 52.67 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.174 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 670' ' ' TRP . . . . . 0.49 ' CE3' HG21 ' B' ' 676' ' ' THR . 98.2 m95 -68.77 -2.86 10.35 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 119.592 -0.843 . . . . 0.0 112.007 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -75.71 -19.09 59.34 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.619 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 5.5 m95 -102.98 -23.2 13.72 Favored 'General case' 0 C--O 1.211 -0.935 0 C-N-CA 120.166 -0.614 . . . . 0.0 111.557 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 64.07 -59.13 0.2 Allowed 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -51.0 -52.39 43.37 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.535 HD12 ' CE3' ' B' ' 678' ' ' TRP . 6.5 tp -68.21 -35.52 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 120.308 -0.557 . . . . 0.0 111.237 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 676' ' ' THR . . . . . 0.49 HG21 ' CE3' ' B' ' 670' ' ' TRP . 15.2 m -62.3 -44.75 95.79 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.319 -0.552 . . . . 0.0 110.689 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -66.3 -46.94 75.22 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.535 ' CE3' HD12 ' B' ' 675' ' ' ILE . 1.1 t90 -64.47 -38.68 91.87 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.534 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 8.3 tp -74.27 -20.19 60.23 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -109.4 9.22 25.62 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 120.573 -0.451 . . . . 0.0 112.006 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -123.53 0.5 8.81 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.065 178.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.5 HG12 HD11 ' B' ' 686' ' ' ILE . 11.3 tt -68.24 -37.78 78.57 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 CA-C-N 116.819 -0.173 . . . . 0.0 111.31 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -56.16 -46.62 79.23 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.489 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 78.2 mt -68.07 -38.12 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.332 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.482 ' HA ' HD12 ' B' ' 688' ' ' ILE . 60.3 t80 -64.78 -40.63 95.58 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.971 -179.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.5 HD11 HG12 ' B' ' 682' ' ' ILE . 48.2 mt -61.84 -42.29 94.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.934 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.6 mt -59.49 -41.76 85.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.479 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 688' ' ' ILE . . . . . 0.482 HD12 ' HA ' ' B' ' 685' ' ' PHE . 79.0 mt -56.69 -41.24 74.01 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 28.1 t -67.35 -28.81 43.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 120.222 -0.591 . . . . 0.0 111.706 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.38 -26.32 43.96 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 119.946 -1.121 . . . . 0.0 110.832 178.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 16.7 m -88.1 -30.21 20.03 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 116.783 0.292 . . . . 0.0 111.351 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.72 -32.56 52.45 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 120.635 0.255 . . . . 0.0 110.618 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.667 ' O ' HD12 ' B' ' 693' ' ' ILE . 0.6 OUTLIER -76.0 -27.73 18.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.892 -179.674 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.76 -55.71 20.89 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 119.383 -1.389 . . . . 0.0 113.743 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.639 HD22 ' N ' ' B' ' 696' ' ' ARG . 0.0 OUTLIER -62.62 -29.89 70.95 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 118.138 0.969 . . . . 0.0 113.314 -178.941 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.639 ' N ' HD22 ' B' ' 695' ' ' LEU . 14.4 mmt180 -49.38 -30.4 7.74 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.725 HD13 ' NH1' ' C' ' 696' ' ' ARG . 43.3 pt -58.35 -38.77 71.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 118.102 0.41 . . . . 0.0 110.796 -178.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.49 HG12 ' O ' ' B' ' 695' ' ' LEU . 3.9 p -54.53 -27.46 17.72 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.37 -177.081 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -54.9 -26.65 37.27 Favored 'General case' 0 C--O 1.214 -0.77 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.796 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -52.67 -35.64 55.55 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 53.3 t -59.65 -31.34 46.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.54 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 34.1 tp -58.22 -33.89 69.82 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.505 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 7.9 m -58.24 -31.8 67.73 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 704' ' ' LEU . . . . . 0.516 ' N ' HD12 ' B' ' 704' ' ' LEU . 6.4 mp -77.63 -43.15 32.38 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 33.5 m -93.0 -10.66 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -178.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -60.74 -34.11 73.93 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.439 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.23 -0.73 52.77 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 61.3 t -84.1 -36.05 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 120.594 -0.443 . . . . 0.0 110.062 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -164.95 23.01 0.06 Allowed 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.44 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 118.305 -0.855 . . . . 0.0 112.394 179.86 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.511 HD23 ' N ' ' C' ' 660' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.56 HD23 ' CG ' ' C' ' 665' ' ' LYS . 0.2 OUTLIER -169.25 -38.94 0.02 OUTLIER 'General case' 0 C--O 1.21 -0.975 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.942 -178.791 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 662' ' ' GLU . . . . . 0.482 ' HG2' ' H ' ' C' ' 665' ' ' LYS . 0.8 OUTLIER 94.38 148.48 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.976 0.91 . . . . 0.0 109.476 -179.282 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 9.3 tt -52.34 -40.35 61.82 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -176.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -67.05 -39.58 86.93 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.353 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 665' ' ' LYS . . . . . 0.56 ' CG ' HD23 ' C' ' 661' ' ' LEU . 1.8 tptt -70.68 -43.5 68.95 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.03 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 666' ' ' TRP . . . . . 0.836 ' NE1' HD13 ' A' ' 661' ' ' LEU . 64.6 m95 -58.85 -48.46 81.28 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.06 -47.32 85.19 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.458 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 2.5 m -61.54 -31.83 71.87 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.337 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.516 HD12 ' C17' ' C' ' 801' ' ' QOJ . 8.8 tp -56.0 -11.51 1.1 Allowed 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -68.68 -18.86 64.34 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -63.87 -44.8 91.99 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 672' ' ' TRP . . . . . 0.487 ' HB2' HG22 ' C' ' 675' ' ' ILE . 14.1 m95 -79.96 -22.79 42.21 Favored 'General case' 0 CA--C 1.553 1.062 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 65.89 -68.93 0.12 Allowed 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 119.976 1.262 . . . . 0.0 112.435 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -52.15 -51.88 55.21 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.541 HG13 HD23 ' C' ' 679' ' ' LEU . 8.8 tp -67.24 -28.96 44.29 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.961 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 22.4 m -58.94 -48.6 80.91 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.976 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -68.8 -43.94 74.61 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.476 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.49 ' O ' HG23 ' C' ' 682' ' ' ILE . 19.9 t90 -63.49 -19.65 64.93 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 679' ' ' LEU . . . . . 0.541 HD23 HG13 ' C' ' 675' ' ' ILE . 1.2 mm? -88.97 -2.62 58.67 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.448 -179.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -134.75 -41.33 0.77 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 120.291 -0.563 . . . . 0.0 111.83 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -62.59 -18.1 61.46 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.49 HG23 ' O ' ' C' ' 678' ' ' TRP . 0.2 OUTLIER -56.11 -36.81 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 119.447 -0.901 . . . . 0.0 110.268 179.782 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -62.82 -40.2 96.65 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 38.1 mm -61.68 -46.91 95.53 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.561 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -67.45 -28.46 67.9 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.409 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.36 -43.58 86.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 21.7 mm -67.33 -42.08 87.17 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 C-N-CA 120.324 -0.551 . . . . 0.0 109.665 179.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 95.9 mt -60.69 -41.32 87.82 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.69 -178.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.605 ' O ' HD12 ' C' ' 692' ' ' LEU . 17.2 m -67.45 -10.95 13.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 C-N-CA 119.119 -1.033 . . . . 0.0 112.934 -176.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -91.56 -8.47 63.95 Favored Glycine 0 CA--C 1.559 2.821 0 C-N-CA 120.055 -1.069 . . . . 0.0 114.424 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 75.5 m -88.81 -34.31 17.1 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.322 1.561 . . . . 0.0 112.847 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 692' ' ' LEU . . . . . 0.838 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -53.73 -31.86 49.92 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.755 -178.15 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.838 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.2 OUTLIER -64.92 -34.76 72.65 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 C-N-CA 121.435 -0.106 . . . . 0.0 111.068 -179.539 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.9 -55.38 31.22 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.611 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.488 HD23 ' C ' ' C' ' 695' ' ' LEU . 8.6 tt -60.72 -46.34 90.78 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.725 ' NH1' HD13 ' B' ' 697' ' ' ILE . 66.1 mtp85 -55.28 -35.78 65.41 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.565 HD11 HD12 ' C' ' 693' ' ' ILE . 68.2 mt -59.23 -41.59 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.497 ' O ' HG22 ' C' ' 701' ' ' VAL . 53.4 t -56.57 -28.09 26.5 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.992 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.209 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 699' ' ' PHE . . . . . 0.579 ' HA ' HD11 ' C' ' 702' ' ' LEU . 4.5 t80 -55.34 -34.94 64.67 Favored 'General case' 0 C--O 1.206 -1.232 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.99 -36.04 78.39 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -176.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 701' ' ' VAL . . . . . 0.497 HG22 ' O ' ' C' ' 698' ' ' VAL . 16.6 m -67.79 -39.68 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -176.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 702' ' ' LEU . . . . . 0.714 ' H ' HD13 ' C' ' 702' ' ' LEU . 0.0 OUTLIER -65.83 -24.12 66.83 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 118.431 -1.308 . . . . 0.0 111.617 -178.821 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 703' ' ' SER . . . . . 0.569 ' N ' HD22 ' C' ' 702' ' ' LEU . 57.3 m -59.19 -40.63 86.32 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 704' ' ' LEU . . . . . 0.42 HD21 ' HD3' ' A' ' 707' ' ' ARG . 15.7 tp -59.06 -27.08 65.19 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 120.295 -0.562 . . . . 0.0 109.911 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 12.3 t -74.27 -26.74 20.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.976 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -60.87 -9.43 4.13 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 5.9 mtt-85 -90.64 -23.91 20.65 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.307 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 49.9 t -91.98 -35.99 7.42 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.548 0 C-N-CA 120.921 -0.311 . . . . 0.0 110.254 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 65.2 ttp85 -100.74 67.2 1.24 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.123 0.487 . . . . 0.0 110.607 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 117.787 -1.101 . . . . 0.0 111.18 179.939 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . 0.549 ' C31' HD12 ' A' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . 0.516 ' C17' HD12 ' C' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' C' ' 667' ' ' ALA . 4.2 mm? . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.482 ' O ' HD12 ' C' ' 663' ' ' LEU . 1.9 mm? -122.86 146.81 47.24 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -157.97 170.16 22.95 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.14 -0.624 . . . . 0.0 111.368 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.572 HD21 ' CD2' ' B' ' 660' ' ' LEU . 4.6 tt -61.76 -40.37 94.92 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.386 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -71.27 -26.63 62.97 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.104 -179.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 33.8 mtpt -70.17 -43.87 69.93 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.567 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 666' ' ' TRP . . . . . 0.475 ' NE1' HD12 ' A' ' 661' ' ' LEU . 89.8 m95 -66.83 -47.98 70.33 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.586 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.36 -30.79 68.66 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 120.471 -0.492 . . . . 0.0 111.01 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.2 t -58.12 -32.47 68.16 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.249 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 25.0 mt -60.01 -11.92 6.89 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.596 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 16.1 m95 -67.93 -42.2 81.39 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.855 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.72 -15.4 58.42 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.856 177.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 672' ' ' TRP . . . . . 0.556 ' O ' ' N ' ' A' ' 674' ' ' ASP . 93.4 m95 -103.19 16.91 25.34 Favored 'General case' 0 C--O 1.21 -0.99 0 CA-C-O 118.742 -0.647 . . . . 0.0 111.776 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -7.24 -49.91 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 115.47 1.655 . . . . 0.0 115.47 -178.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 674' ' ' ASP . . . . . 0.556 ' N ' ' O ' ' A' ' 672' ' ' TRP . 25.8 t70 -50.8 -52.34 41.96 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 119.175 -0.44 . . . . 0.0 111.459 179.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.518 HG22 ' HB3' ' A' ' 672' ' ' TRP . 8.5 tp -68.65 -30.74 48.29 Favored 'Isoleucine or valine' 0 C--N 1.354 0.779 0 C-N-CA 119.477 -0.889 . . . . 0.0 111.131 179.451 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.4 m -59.2 -44.49 92.25 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -60.4 -44.18 95.95 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.475 ' CE3' HD11 ' A' ' 675' ' ' ILE . 54.6 t90 -58.15 -34.86 70.75 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.153 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 53.5 mt -84.6 -2.82 57.99 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -136.29 7.81 3.13 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -179.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -129.52 -27.62 2.37 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 120.197 -0.601 . . . . 0.0 111.769 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.4 HG22 ' O ' ' A' ' 678' ' ' TRP . 16.6 tt -61.49 -37.73 78.47 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.149 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 34.4 ttp-105 -55.75 -48.38 75.34 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 120.292 -0.563 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.439 ' N ' HD12 ' A' ' 684' ' ' ILE . 1.8 mp -60.68 -45.93 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -52.78 -40.91 63.62 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 121.219 -0.192 . . . . 0.0 111.335 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.546 ' CG1' HG21 ' C' ' 686' ' ' ILE . 1.3 mp -58.16 -38.04 65.79 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 CA-C-O 119.24 -0.41 . . . . 0.0 110.544 -179.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.37 -43.26 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.198 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 688' ' ' ILE . . . . . 0.615 HD12 ' H ' ' A' ' 688' ' ' ILE . 4.0 mp -62.27 -41.46 91.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.614 ' O ' HD11 ' A' ' 692' ' ' LEU . 46.7 t -68.49 3.74 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 690' ' ' GLY . . . . . 0.417 ' O ' HG22 ' A' ' 693' ' ' ILE . . . -109.31 -9.86 24.83 Favored Glycine 0 CA--C 1.545 1.911 0 C-N-CA 120.911 -0.661 . . . . 0.0 111.492 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.7 m -88.17 -28.66 21.07 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 117.098 0.449 . . . . 0.0 112.051 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.614 HD11 ' O ' ' A' ' 689' ' ' VAL . 0.2 OUTLIER -53.51 -32.32 49.94 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.335 -178.299 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.592 HD11 ' HG2' ' B' ' 696' ' ' ARG . 4.8 tp -53.88 -39.56 40.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.569 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -70.57 -36.97 68.37 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 177.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.572 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.4 OUTLIER -56.65 -31.85 64.77 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.533 -0.334 . . . . 0.0 110.962 179.343 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.514 ' HG3' HD11 ' C' ' 693' ' ' ILE . 30.1 mmt180 -61.61 -35.92 79.26 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 61.1 mt -59.15 -41.38 83.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 CA-C-O 118.973 -0.537 . . . . 0.0 112.092 -176.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.648 ' O ' HG12 ' A' ' 701' ' ' VAL . 5.3 p -56.76 -29.09 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 118.865 0.757 . . . . 0.0 111.473 -179.125 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -55.68 -35.37 65.94 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.242 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.39 -35.41 65.28 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.383 -178.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 698' ' ' VAL . 1.3 p -59.6 -31.67 47.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 178.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 11.3 tp -58.64 -24.53 61.33 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.796 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 68.4 m -57.57 -43.24 84.4 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.396 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.45 -42.93 99.82 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.57 -34.17 66.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.19 178.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -67.27 -32.14 72.95 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.584 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -73.94 -22.2 59.75 Favored 'General case' 0 C--O 1.219 -0.506 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.556 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 59.6 t -82.97 -36.18 12.82 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.496 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.127 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -142.79 -76.34 0.26 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.374 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.607 179.725 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.572 ' CD2' HD21 ' A' ' 663' ' ' LEU . 4.3 mp . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.81 136.96 53.08 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.597 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -149.82 175.38 11.68 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 123.34 0.4 . . . . 0.0 110.797 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.462 HD23 ' N ' ' B' ' 664' ' ' ASP . 0.2 OUTLIER -64.77 -40.22 94.91 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.792 178.447 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 664' ' ' ASP . . . . . 0.462 ' N ' HD23 ' B' ' 663' ' ' LEU . 4.4 p-10 -68.97 -26.33 64.98 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.867 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 4.0 tttm -68.85 -41.45 78.44 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.318 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -72.93 -53.58 10.92 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.297 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 667' ' ' ALA . . . . . 0.518 ' HB2' HD12 ' C' ' 660' ' ' LEU . . . -56.31 -25.84 50.08 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.704 -179.194 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 53.6 p -58.62 -31.84 68.46 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.898 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.774 HD22 HG21 ' B' ' 675' ' ' ILE . 67.8 mt -71.84 -15.07 62.13 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 18.7 m95 -69.08 -2.4 10.04 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -74.36 -48.16 29.78 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.029 -0.669 . . . . 0.0 110.696 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 6.7 p90 -103.3 -22.49 13.69 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.131 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.02 2.25 0.39 Allowed 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.3 -52.97 59.76 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 118.283 0.492 . . . . 0.0 111.435 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.774 HG21 HD22 ' B' ' 669' ' ' LEU . 6.8 tp -68.21 -31.46 51.71 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.619 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.073 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.1 m -59.2 -43.21 92.24 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.449 -179.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -67.28 -38.58 85.3 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.377 -179.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.787 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.9 t90 -72.15 -46.25 57.23 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.635 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 679' ' ' LEU . . . . . 0.429 HD12 HG13 ' B' ' 675' ' ' ILE . 14.6 mt -75.33 -33.14 61.1 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -84.74 10.46 11.32 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 119.947 -0.701 . . . . 0.0 112.41 -178.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -128.96 -5.55 5.03 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 120.759 -0.377 . . . . 0.0 111.98 179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.787 HG23 ' O ' ' B' ' 678' ' ' TRP . 2.2 pp -67.74 -43.14 86.66 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.713 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.519 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 19.1 mtp-105 -55.88 -47.89 76.55 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.186 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 84.3 mt -67.91 -38.48 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.389 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -55.26 -37.91 67.87 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 121.06 -0.256 . . . . 0.0 111.61 -178.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.943 HG21 HD12 ' C' ' 686' ' ' ILE . 16.2 mm -60.99 -40.81 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.034 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.87 -41.57 83.24 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 32.1 mm -57.51 -42.84 81.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.501 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 48.6 t -68.57 -8.65 10.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.554 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.51 -37.87 13.46 Favored Glycine 0 C--N 1.349 1.259 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.64 -27.59 62.23 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.825 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.13 -54.59 43.31 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.518 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.704 HD11 ' HD3' ' C' ' 696' ' ' ARG . 0.7 OUTLIER -55.57 -28.73 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.917 -179.266 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 694' ' ' GLY . . . . . 0.526 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -67.35 -50.49 44.18 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 119.46 -1.352 . . . . 0.0 111.235 -179.149 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.495 ' O ' HG12 ' B' ' 698' ' ' VAL . 2.1 mt -56.76 -31.83 65.0 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.592 ' HG2' HD11 ' A' ' 693' ' ' ILE . 0.6 OUTLIER -50.59 -30.66 13.83 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -179.249 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.526 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.1 tp -58.78 -41.04 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -176.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.495 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.2 p -56.13 -28.11 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-N 118.279 0.491 . . . . 0.0 111.517 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -55.25 -26.84 42.37 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.587 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.48 -36.24 66.39 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 120.402 -0.519 . . . . 0.0 109.832 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 77.9 t -64.82 -41.34 91.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 702' ' ' LEU . . . . . 0.425 HD23 ' C ' ' B' ' 702' ' ' LEU . 10.4 tt -61.13 -38.34 86.03 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.476 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 24.3 p -59.6 -32.66 70.6 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.273 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.91 -42.33 97.44 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.103 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 59.8 t -63.1 -18.99 22.64 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.954 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.41 -34.05 75.98 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.84 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -73.81 -26.59 60.7 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.546 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 47.2 t -82.85 -36.12 12.9 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.505 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.336 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 29.1 ttt85 -150.36 -67.35 0.2 Allowed 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.824 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.419 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.518 HD12 ' HB2' ' B' ' 667' ' ' ALA . 2.1 tt . . . . . 0 N--CA 1.487 1.384 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.426 HD23 ' C8 ' ' C' ' 801' ' ' QOJ . 0.2 OUTLIER -117.42 -160.67 0.78 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 178.669 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.79 141.93 26.08 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 119.884 -0.726 . . . . 0.0 110.897 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.495 ' C ' HD23 ' C' ' 663' ' ' LEU . 9.7 tt -61.33 -40.17 93.22 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.924 179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -74.06 -25.7 59.98 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.868 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -67.21 -39.83 86.35 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.974 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -62.25 -50.35 72.07 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 667' ' ' ALA . . . . . 0.516 ' HB2' ' HG ' ' A' ' 660' ' ' LEU . . . -66.55 -35.62 80.68 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.299 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 59.7 p -57.73 -31.93 66.93 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.073 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 62.7 mt -60.71 -10.1 4.89 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 120.354 -0.538 . . . . 0.0 111.991 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -68.73 -13.24 62.26 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.877 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -62.82 -44.68 95.52 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.981 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -79.8 -12.8 59.75 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 119.638 -0.825 . . . . 0.0 113.146 -177.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.3 t80 69.17 -63.99 0.35 Allowed 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.734 1.152 . . . . 0.0 112.286 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -57.21 -37.56 72.39 Favored 'General case' 0 C--O 1.218 -0.588 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.508 HD12 ' CE3' ' C' ' 678' ' ' TRP . 8.5 tp -67.73 -37.2 78.19 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.885 -179.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 4.4 m -60.97 -49.52 77.12 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.272 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -70.0 -45.07 68.06 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 120.43 -0.508 . . . . 0.0 109.634 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.508 ' CE3' HD12 ' C' ' 675' ' ' ILE . 20.2 t90 -55.89 -23.21 29.94 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.297 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 48.2 mt -94.12 -25.48 17.13 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.448 -0.501 . . . . 0.0 112.148 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -109.27 11.94 25.1 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -122.26 -28.01 4.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.613 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.2 pp -61.2 -41.7 90.55 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.759 0 C-N-CA 120.466 -0.493 . . . . 0.0 111.582 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 31.7 ttp-105 -58.47 -48.29 81.24 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.429 -0.508 . . . . 0.0 111.119 -179.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 78.8 mt -67.67 -43.28 86.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.616 ' HA ' HD12 ' C' ' 688' ' ' ILE . 2.3 m-85 -52.82 -28.18 21.57 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.902 -178.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.943 HD12 HG21 ' B' ' 686' ' ' ILE . 20.8 mm -58.25 -38.05 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.041 -178.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.5 mt -61.3 -42.0 91.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' C' ' 685' ' ' PHE . 68.5 mt -63.49 -41.16 91.7 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.73 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 689' ' ' VAL . . . . . 0.612 ' O ' HD12 ' C' ' 692' ' ' LEU . 90.2 t -67.18 -26.15 35.66 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 CA-C-O 118.578 -0.725 . . . . 0.0 112.412 -176.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -83.94 2.86 87.03 Favored Glycine 0 CA--C 1.55 2.225 0 C-N-CA 119.855 -1.164 . . . . 0.0 113.046 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 67.6 m -88.98 -34.57 16.8 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.657 1.229 . . . . 0.0 112.603 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 692' ' ' LEU . . . . . 0.892 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -68.7 -31.93 71.37 Favored 'General case' 0 C--O 1.22 -0.492 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.592 -178.47 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.892 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.1 OUTLIER -63.08 -32.39 56.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.803 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.81 -41.34 99.61 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.495 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.67 ' O ' HG22 ' C' ' 698' ' ' VAL . 0.3 OUTLIER -56.41 -31.47 63.92 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 117.351 0.575 . . . . 0.0 112.389 -179.148 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.704 ' HD3' HD11 ' B' ' 693' ' ' ILE . 0.9 OUTLIER -50.71 -36.18 34.93 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -178.375 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 1.3 pt -59.4 -41.39 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 CA-C-N 119.273 0.942 . . . . 0.0 113.311 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.725 ' O ' HG12 ' C' ' 701' ' ' VAL . 5.2 m -56.41 -27.77 25.2 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.838 0 C-N-CA 119.088 -1.045 . . . . 0.0 111.541 -178.489 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -54.84 -35.43 63.97 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.838 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.67 66.45 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.952 -179.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 701' ' ' VAL . . . . . 0.725 HG12 ' O ' ' C' ' 698' ' ' VAL . 2.7 p -59.74 -31.48 47.31 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.961 178.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.7 tp -58.38 -26.2 62.93 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.746 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 2.3 m -58.56 -39.28 79.82 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.054 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 15.5 tp -59.55 -39.47 84.1 Favored 'General case' 0 C--O 1.218 -0.568 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 12.8 t -76.1 -16.79 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.156 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -60.63 -28.24 68.4 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 34.9 ptt85 -78.66 -24.28 45.24 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 120.612 -0.435 . . . . 0.0 111.53 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 708' ' ' VAL . . . . . 0.527 ' O ' HG12 ' C' ' 708' ' ' VAL . 18.6 t -100.23 26.24 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-O 120.661 0.267 . . . . 0.0 110.795 -179.368 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 -53.37 129.35 31.68 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.867 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.625 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . 0.426 ' C8 ' HD23 ' C' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.443 ' N ' HD11 ' C' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.702 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 45.0 mt -132.5 -73.52 0.51 Allowed 'General case' 0 C--O 1.213 -0.816 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.52 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 69.33 147.52 0.06 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.642 0.258 . . . . 0.0 111.034 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 663' ' ' LEU . . . . . 0.586 HD22 ' C ' ' A' ' 663' ' ' LEU . 0.0 OUTLIER -53.56 -17.59 2.21 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.851 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -73.86 -37.13 64.87 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.042 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -70.29 -42.37 72.15 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.391 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -60.36 -50.06 75.12 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.458 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.99 80.11 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.094 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.2 m -57.44 -32.49 66.96 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.397 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.61 -14.69 45.83 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.882 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -68.44 -8.95 45.27 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.117 -0.633 . . . . 0.0 111.576 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -62.61 -48.02 81.22 Favored 'General case' 0 C--O 1.218 -0.585 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.183 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -102.47 -23.01 13.96 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.016 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 673' ' ' PHE . . . . . 0.41 ' HE1' HD21 ' A' ' 677' ' ' ASN . 7.2 t80 51.8 6.99 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 178.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.81 -52.81 58.51 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 118.873 0.76 . . . . 0.0 111.534 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.445 ' CG2' HD12 ' A' ' 679' ' ' LEU . 41.0 mm -68.39 -42.39 84.07 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.685 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 1.4 m -62.76 -44.81 95.21 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.233 -178.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 677' ' ' ASN . . . . . 0.41 HD21 ' HE1' ' A' ' 673' ' ' PHE . 16.1 t-20 -59.95 -46.74 88.43 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.304 -179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.439 ' CZ2' HD12 ' A' ' 682' ' ' ILE . 7.8 t-105 -71.0 -46.51 62.14 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 120.628 -0.429 . . . . 0.0 112.134 -178.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.445 HD12 ' CG2' ' A' ' 675' ' ' ILE . 96.5 mt -74.79 -11.25 60.11 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -176.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -70.35 -3.47 17.53 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 118.927 -1.109 . . . . 0.0 110.884 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -149.44 12.91 0.83 Allowed 'General case' 0 C--N 1.352 0.685 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.22 178.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.439 HD12 ' CZ2' ' A' ' 678' ' ' TRP . 14.9 tt -55.76 -39.63 56.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 118.841 0.746 . . . . 0.0 109.265 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 -70.16 -40.3 74.82 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.495 -0.482 . . . . 0.0 109.779 178.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 31.7 mt -59.73 -42.1 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.63 -37.65 58.82 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.886 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 17.5 mm -58.45 -38.66 71.33 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 C-N-CA 120.214 -0.594 . . . . 0.0 110.344 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.5 -42.91 85.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 56.4 mt -60.63 -42.91 93.51 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.441 ' O ' HG12 ' A' ' 689' ' ' VAL . 57.7 t -68.5 -2.49 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.21 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.883 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -92.94 -34.04 7.03 Favored Glycine 0 C--N 1.352 1.417 0 N-CA-C 109.966 -1.253 . . . . 0.0 109.966 178.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 56.8 m -80.36 -24.87 39.52 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -58.42 -42.62 87.63 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.224 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 3.5 tp -65.3 -28.07 43.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.52 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 694' ' ' GLY . . . . . 0.604 ' O ' HG22 ' A' ' 697' ' ' ILE . . . -69.83 -51.59 23.77 Favored Glycine 0 C--O 1.212 -1.257 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 178.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.41 -31.84 64.28 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-O 120.491 0.186 . . . . 0.0 110.501 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 0.1 OUTLIER -56.61 -37.24 70.42 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.601 179.725 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 697' ' ' ILE . . . . . 0.681 HD11 ' HB3' ' B' ' 699' ' ' PHE . 7.3 tp -60.62 -41.2 87.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 119.722 -0.791 . . . . 0.0 110.406 -179.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.623 ' O ' HG22 ' A' ' 701' ' ' VAL . 2.2 t -56.89 -28.97 29.6 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.632 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 699' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 13.8 m-85 -58.32 -34.57 70.74 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 178.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.7 -35.72 63.91 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 698' ' ' VAL . 25.1 m -60.62 -36.77 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.766 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 6.2 tt -58.99 -30.5 68.01 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.222 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 38.5 t -58.65 -44.97 90.25 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.794 -179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.52 HD23 ' O ' ' A' ' 704' ' ' LEU . 5.3 tt -66.91 -36.07 81.43 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-O 120.927 0.394 . . . . 0.0 110.112 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 59.7 t -60.59 -26.87 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.695 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -62.59 -34.13 76.37 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 112.322 0.489 . . . . 0.0 112.322 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -80.01 -6.2 57.16 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 120.146 -0.622 . . . . 0.0 112.352 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.525 HG12 ' O ' ' A' ' 708' ' ' VAL . 17.1 t -89.28 25.98 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.508 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 -56.63 112.23 1.23 Allowed 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.441 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 . . . . . 0 C--O 1.219 -0.54 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.999 -179.821 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 4.6 mp . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 mt 54.63 97.68 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.747 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -151.82 -179.69 7.67 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.016 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.9 tt -52.88 -36.15 58.79 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.073 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.05 -37.5 69.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.622 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -46.19 65.5 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.72 -179.184 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 93.4 m95 -62.57 -38.45 90.13 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.59 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 667' ' ' ALA . . . . . 0.54 ' HB2' HD22 ' C' ' 660' ' ' LEU . . . -72.05 -31.46 66.16 Favored 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.082 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 6.9 t -57.37 -32.08 66.43 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.409 -0.516 . . . . 0.0 110.292 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.411 ' HG ' ' CH2' ' B' ' 672' ' ' TRP . 5.9 mp -61.0 -15.61 33.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.96 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 9.9 m95 -68.66 -2.97 10.33 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 118.965 -0.541 . . . . 0.0 112.405 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -89.04 -49.57 6.68 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.935 -178.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 672' ' ' TRP . . . . . 0.411 ' CH2' ' HG ' ' B' ' 669' ' ' LEU . 4.7 p-90 -104.21 -24.15 13.17 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.666 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 2.4 t80 47.5 -4.18 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.336 0 N-CA-C 116.951 2.204 . . . . 0.0 116.951 176.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 674' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' B' ' 672' ' ' TRP . 2.7 m-20 -63.73 -54.39 36.23 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 121.061 1.755 . . . . 0.0 113.053 -177.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.426 HD13 ' HA ' ' B' ' 675' ' ' ILE . 10.7 mm -69.91 -27.59 33.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.837 178.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 34.1 m -58.66 -46.81 86.36 Favored 'General case' 0 C--O 1.22 -0.478 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.7 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -65.49 -31.74 72.97 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 120.489 -0.484 . . . . 0.0 109.855 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.49 ' CZ3' HD21 ' B' ' 679' ' ' LEU . 33.8 t90 -67.38 -45.52 76.0 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.113 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 679' ' ' LEU . . . . . 0.49 HD21 ' CZ3' ' B' ' 678' ' ' TRP . 64.4 mt -81.12 -23.27 38.46 Favored 'General case' 0 C--O 1.22 -0.464 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -177.686 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 9.3 t90 -92.53 0.62 57.45 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.83 -0.748 . . . . 0.0 112.385 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -130.23 -1.12 4.56 Favored 'General case' 0 C--O 1.218 -0.603 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.572 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 6.4 tp -65.89 -44.1 92.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 C-N-CA 120.512 -0.475 . . . . 0.0 111.664 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.94 -40.03 75.65 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.283 -179.212 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 92.8 mt -68.17 -43.86 84.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.537 ' HA ' HD13 ' B' ' 688' ' ' ILE . 2.5 m-85 -54.74 -28.4 48.17 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.39 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.493 HG21 HD12 ' C' ' 686' ' ' ILE . 19.0 mm -58.65 -40.36 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.921 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.81 -41.63 83.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 688' ' ' ILE . . . . . 0.537 HD13 ' HA ' ' B' ' 685' ' ' PHE . 3.7 mp -61.94 -41.46 91.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.214 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 46.5 t -67.8 -10.13 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 120.424 -0.51 . . . . 0.0 112.025 -177.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -77.81 -39.99 23.07 Favored Glycine 0 C--N 1.346 1.112 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 24.2 m -74.07 -17.26 60.98 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.706 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -33.7 68.97 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.27 -179.071 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.548 HG12 HD13 ' C' ' 692' ' ' LEU . 2.3 pp -70.9 -39.05 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.763 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 694' ' ' GLY . . . . . 0.551 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -63.41 -42.93 98.94 Favored Glycine 0 C--O 1.217 -0.926 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.412 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.5 OUTLIER -56.26 -31.4 63.54 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 120.584 0.231 . . . . 0.0 111.088 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.511 ' HE ' HD13 ' A' ' 697' ' ' ILE . 1.0 OUTLIER -50.27 -30.48 11.9 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.795 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.551 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.2 tp -58.9 -40.75 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -175.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.412 HG12 ' O ' ' B' ' 695' ' ' LEU . 7.4 p -55.96 -28.74 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 118.912 0.778 . . . . 0.0 111.747 -178.225 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 699' ' ' PHE . . . . . 0.681 ' HB3' HD11 ' A' ' 697' ' ' ILE . 14.9 m-85 -55.52 -24.17 30.38 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 179.639 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -48.61 -34.63 11.98 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -177.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 33.3 m -58.66 -31.16 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.23 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 39.1 tp -58.24 -35.76 72.2 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.366 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.2 m -58.23 -31.89 67.81 Favored 'General case' 0 C--O 1.218 -0.603 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.689 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 704' ' ' LEU . . . . . 0.439 HD22 ' N ' ' B' ' 704' ' ' LEU . 3.9 mm? -68.74 -43.5 75.76 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 120.187 -0.605 . . . . 0.0 112.078 -178.597 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 34.2 m -95.45 -10.3 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -60.62 -15.34 27.21 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 119.832 -0.747 . . . . 0.0 111.662 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 707' ' ' ARG . . . . . 0.521 ' HG3' HG13 ' B' ' 708' ' ' VAL . 21.3 ptt180 -85.89 -34.39 20.99 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 120.489 -0.484 . . . . 0.0 111.189 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.521 HG13 ' HG3' ' B' ' 707' ' ' ARG . 27.8 m -91.4 26.08 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 120.858 -0.337 . . . . 0.0 111.381 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 23.7 mmt180 -50.8 146.61 5.69 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.185 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.662 -179.982 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.54 HD22 ' HB2' ' B' ' 667' ' ' ALA . 6.1 mp . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 661' ' ' LEU . . . . . 0.488 HD21 ' CZ2' ' C' ' 666' ' ' TRP . 4.6 tp 53.96 -153.62 0.28 Allowed 'General case' 0 CA--C 1.549 0.94 0 CA-C-O 118.447 -0.787 . . . . 0.0 110.193 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 122.21 168.68 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 125.861 1.664 . . . . 0.0 109.685 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.443 HD11 ' N ' ' A' ' 660' ' ' LEU . 10.2 tt -61.08 -40.07 92.31 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.751 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -72.22 -23.83 61.3 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.862 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -69.05 -41.59 77.42 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.844 -178.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 666' ' ' TRP . . . . . 0.488 ' CZ2' HD21 ' C' ' 661' ' ' LEU . 94.2 m95 -65.37 -44.08 88.74 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.317 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.09 -30.67 60.17 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.391 -178.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 92.9 p -59.91 -32.79 71.09 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.904 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 32.6 mt -66.59 -6.9 16.93 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -77.2 -17.6 58.38 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -62.77 -50.01 72.72 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 119.009 -1.077 . . . . 0.0 110.953 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 672' ' ' TRP . . . . . 0.411 ' O ' ' N ' ' C' ' 674' ' ' ASP . 7.7 p90 -96.03 -22.88 17.09 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 43.3 p90 45.45 3.21 0.0 OUTLIER 'General case' 0 C--N 1.364 1.206 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 674' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' C' ' 672' ' ' TRP . 7.2 t0 -64.24 -53.63 46.04 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 120.069 1.304 . . . . 0.0 110.463 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 8.4 tp -69.54 -29.23 40.81 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.918 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.357 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.2 m -58.63 -38.03 77.2 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 123.123 0.264 . . . . 0.0 111.393 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -59.97 -47.08 87.3 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 120.009 -0.677 . . . . 0.0 109.947 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.549 ' HD1' HG21 ' C' ' 682' ' ' ILE . 13.1 t90 -72.53 -37.08 68.41 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.238 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -2.45 6.29 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.09 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -142.57 153.31 43.42 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-O 122.083 0.944 . . . . 0.0 112.187 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 681' ' ' TYR . . . . . 0.475 ' HB2' HD12 ' C' ' 684' ' ' ILE . 5.4 p90 56.98 -3.81 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.792 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.4 pp -62.98 -34.88 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 119.572 1.078 . . . . 0.0 109.244 176.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 683' ' ' ARG . . . . . 0.792 ' N ' HD12 ' C' ' 682' ' ' ILE . 19.1 ttp-105 -54.47 -31.17 55.16 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.117 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 684' ' ' ILE . . . . . 0.475 HD12 ' HB2' ' C' ' 681' ' ' TYR . 89.5 mt -59.49 -48.08 88.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 120.516 -0.473 . . . . 0.0 109.834 179.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.418 ' HA ' HD13 ' C' ' 688' ' ' ILE . 27.9 m-85 -53.81 -27.96 32.49 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.284 -178.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.493 HD12 HG21 ' B' ' 686' ' ' ILE . 31.4 mm -57.83 -38.09 63.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.942 -177.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.3 -42.11 86.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.418 HD13 ' HA ' ' C' ' 685' ' ' PHE . 3.8 mp -67.97 -41.56 84.74 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.731 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 93.3 t -67.82 -31.09 50.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.312 -178.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -77.42 13.45 11.14 Favored Glycine 0 CA--C 1.543 1.81 0 CA-C-N 120.166 1.348 . . . . 0.0 112.24 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 8.9 m -88.69 -34.13 17.32 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 117.797 0.798 . . . . 0.0 111.569 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 692' ' ' LEU . . . . . 0.638 HD12 ' H ' ' C' ' 693' ' ' ILE . 0.2 OUTLIER -53.86 -32.46 53.2 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.416 -179.731 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.638 ' H ' HD12 ' C' ' 692' ' ' LEU . 0.2 OUTLIER -55.14 -37.78 44.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.584 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.28 -42.52 97.36 Favored Glycine 0 CA--C 1.537 1.419 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 177.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.689 ' O ' HG22 ' C' ' 698' ' ' VAL . 0.3 OUTLIER -56.46 -30.46 62.92 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 179.534 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -49.75 -36.0 24.26 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -177.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 3.7 pt -59.37 -41.48 84.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 CA-C-N 119.577 1.081 . . . . 0.0 113.551 -176.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.763 ' O ' HG12 ' C' ' 701' ' ' VAL . 12.3 m -56.38 -27.94 25.41 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.894 0 C-N-CA 119.209 -0.996 . . . . 0.0 111.542 -178.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -54.8 -34.83 63.2 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.11 -35.86 65.09 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 119.197 -0.43 . . . . 0.0 111.803 -177.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 701' ' ' VAL . . . . . 0.763 HG12 ' O ' ' C' ' 698' ' ' VAL . 9.8 p -64.39 -33.08 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.339 178.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.89 -40.48 88.89 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.521 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 16.1 m -60.51 -34.87 74.71 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.348 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 24.8 tp -58.29 -42.83 87.45 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.319 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 19.0 m -85.78 -10.8 11.34 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -61.34 -25.95 67.49 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.546 -0.461 . . . . 0.0 111.789 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -80.07 -21.36 43.48 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 120.455 -0.498 . . . . 0.0 112.252 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 29.5 m -96.12 -29.72 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.0 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.52 178.03 5.48 Favored 'General case' 0 C--O 1.219 -0.507 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.375 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.8 -179.793 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.718 ' CD1' ' HB2' ' C' ' 667' ' ' ALA . 29.1 mt . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.485 HD22 ' NE1' ' C' ' 666' ' ' TRP . 5.5 mp -126.31 -142.51 0.29 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-O 118.647 -0.692 . . . . 0.0 109.841 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 662' ' ' GLU . . . . . 0.507 ' HA ' HD22 ' B' ' 661' ' ' LEU . 0.8 OUTLIER 73.38 130.94 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.429 1.013 . . . . 0.0 109.096 -178.211 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -19.2 2.35 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.065 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -63.62 -48.44 77.33 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -71.48 -44.43 64.76 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.73 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -58.5 -35.23 71.92 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.577 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -53.75 -47.36 70.73 Favored 'General case' 0 C--O 1.215 -0.756 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.8 t -53.44 -32.56 50.4 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.321 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.462 HD12 HG23 ' A' ' 675' ' ' ILE . 0.0 OUTLIER -78.43 -14.56 59.32 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.22 -179.433 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -68.46 -17.15 64.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.78 -179.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -68.03 -48.6 65.21 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.534 -178.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 4.7 p90 -103.46 -23.15 13.55 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 121.304 -0.158 . . . . 0.0 111.22 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 p90 40.58 18.32 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -63.87 -53.12 55.6 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 118.741 0.701 . . . . 0.0 110.945 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.462 HG23 HD12 ' A' ' 669' ' ' LEU . 7.2 tp -68.86 -27.93 37.71 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.912 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.093 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.0 m -58.96 -39.33 81.36 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.511 -179.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.04 -47.06 86.41 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.597 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 678' ' ' TRP . . . . . 0.594 ' O ' HG23 ' A' ' 682' ' ' ILE . 4.9 t90 -72.69 -46.25 54.75 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.9 tp -75.41 -33.26 60.95 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -176.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 13.8 t90 -89.92 4.78 48.94 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 119.691 -0.803 . . . . 0.0 112.449 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -125.06 2.54 7.97 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 120.255 -0.578 . . . . 0.0 112.349 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.594 HG23 ' O ' ' A' ' 678' ' ' TRP . 2.6 pp -55.88 -43.34 74.18 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 C-N-CA 119.884 -0.727 . . . . 0.0 110.838 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.574 ' N ' HD12 ' A' ' 682' ' ' ILE . 0.0 OUTLIER -70.46 -48.28 56.62 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 121.114 -0.235 . . . . 0.0 110.698 179.705 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 97.2 mt -60.34 -46.72 94.59 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.361 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -52.76 -28.5 22.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.621 HG13 HD12 ' B' ' 686' ' ' ILE . 27.4 mm -58.12 -42.28 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.652 -178.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 47.7 mt -58.28 -41.73 81.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 120.031 -0.668 . . . . 0.0 109.342 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 36.3 mm -57.18 -41.95 78.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.554 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.435 ' O ' HG12 ' A' ' 689' ' ' VAL . 59.4 t -68.13 -6.42 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.073 0 C-N-CA 120.659 -0.417 . . . . 0.0 111.339 -179.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -70.67 -40.86 65.61 Favored Glycine 0 C--N 1.35 1.338 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 178.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -72.23 -33.46 67.57 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.327 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.68 -47.39 85.53 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.581 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.779 HD13 ' O ' ' A' ' 693' ' ' ILE . 0.1 OUTLIER -67.68 -35.14 71.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.641 -179.341 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -66.2 -40.19 94.77 Favored Glycine 0 CA--C 1.531 1.093 0 N-CA-C 110.039 -1.225 . . . . 0.0 110.039 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.583 HD23 ' O ' ' A' ' 695' ' ' LEU . 3.1 tt -56.62 -31.82 64.68 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 115.665 -0.267 . . . . 0.0 111.486 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -50.79 -35.26 31.08 Favored 'General case' 0 C--O 1.215 -0.763 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 20.5 tt -58.49 -40.53 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -175.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.532 HG22 ' O ' ' A' ' 695' ' ' LEU . 16.0 m -55.69 -28.69 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 119.041 0.837 . . . . 0.0 111.1 -178.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -56.41 -35.93 68.35 Favored 'General case' 0 C--O 1.214 -0.811 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.836 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.55 -50.7 71.11 Favored 'General case' 0 C--O 1.219 -0.511 0 O-C-N 123.262 0.351 . . . . 0.0 111.28 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 22.7 m -68.56 -38.83 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.115 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.1 tt -66.17 -24.64 66.68 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.424 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 68.9 m -61.68 -44.57 96.69 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.757 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.8 tp -64.36 -36.1 83.03 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.065 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 87.4 t -60.79 -36.31 70.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.951 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -60.93 -18.16 55.29 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.883 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 10.2 ttm180 -73.87 -40.32 63.31 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 121.198 -0.201 . . . . 0.0 110.915 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 708' ' ' VAL . . . . . 0.512 HG12 ' O ' ' A' ' 708' ' ' VAL . 16.3 t -96.14 25.44 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.595 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 42.2 ttm-85 -65.62 123.23 19.13 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.43 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 8.6 mp0 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.629 179.808 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.467 ' N ' HD12 ' B' ' 660' ' ' LEU . 7.8 mp . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 662' ' ' GLU . 19.2 tp 59.77 153.69 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 121.623 0.725 . . . . 0.0 111.565 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 662' ' ' GLU . . . . . 0.402 ' N ' ' HG ' ' B' ' 661' ' ' LEU . 1.3 mp0 -95.62 42.47 1.09 Allowed 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.224 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 663' ' ' LEU . . . . . 0.495 HD21 ' N ' ' C' ' 660' ' ' LEU . 7.4 tt -54.6 -41.57 70.09 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.986 -179.052 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -75.07 -34.67 61.83 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.725 178.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 11.5 tmtt? -70.57 -34.56 72.33 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 123.44 0.462 . . . . 0.0 110.766 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -58.6 -54.8 43.0 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 667' ' ' ALA . . . . . 0.654 ' HB2' ' HG ' ' C' ' 660' ' ' LEU . . . -70.68 -42.96 70.02 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.666 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 37.4 t -54.57 -31.28 56.43 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.358 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.626 HD11 HG23 ' B' ' 675' ' ' ILE . 0.2 OUTLIER -55.58 -25.65 39.37 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.111 -179.27 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -68.52 -2.81 9.62 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.104 -0.638 . . . . 0.0 111.654 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -80.35 -28.7 37.99 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.795 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 672' ' ' TRP . . . . . 0.489 ' HB2' HG22 ' B' ' 675' ' ' ILE . 7.4 m95 -87.62 -23.14 24.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.521 -179.049 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 66.5 -59.85 0.34 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 178.615 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -57.44 -52.63 64.59 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -177.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.626 HG23 HD11 ' B' ' 669' ' ' LEU . 5.2 tp -68.54 -34.45 65.49 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.811 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.4 m -60.37 -37.4 80.62 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 120.036 -0.665 . . . . 0.0 110.241 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -59.95 -46.44 89.39 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.759 ' O ' HG23 ' B' ' 682' ' ' ILE . 7.0 t90 -71.64 -30.6 65.93 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.087 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.96 -7.51 58.1 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -118.25 -20.2 8.66 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 120.642 -0.423 . . . . 0.0 112.102 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -95.2 0.87 54.44 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.25 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 682' ' ' ILE . . . . . 0.759 HG23 ' O ' ' B' ' 678' ' ' TRP . 4.7 pt -56.39 -43.46 77.52 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.839 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 25.9 ttp-105 -55.68 -46.55 77.56 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.812 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.3 mp -67.39 -37.84 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 685' ' ' PHE . . . . . 0.797 ' HA ' HD12 ' B' ' 688' ' ' ILE . 2.4 t80 -55.32 -41.54 72.56 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.074 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.621 HD12 HG13 ' A' ' 686' ' ' ILE . 3.5 mm -60.95 -45.15 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.373 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 65.7 mt -58.93 -41.48 83.16 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 688' ' ' ILE . . . . . 0.797 HD12 ' HA ' ' B' ' 685' ' ' PHE . 62.2 mt -56.9 -41.87 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.473 ' O ' HG12 ' B' ' 689' ' ' VAL . 47.0 t -68.37 -2.24 1.87 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.12 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.261 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -83.77 -42.73 7.58 Favored Glycine 0 C--N 1.349 1.274 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 68.0 m -73.43 -21.8 60.37 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.932 -0.307 . . . . 0.0 111.063 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.15 -41.63 75.71 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.453 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.667 ' O ' HD12 ' B' ' 693' ' ' ILE . 0.6 OUTLIER -72.25 -32.78 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.525 -179.654 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 694' ' ' GLY . . . . . 0.551 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -67.3 -47.01 66.07 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 119.661 -1.257 . . . . 0.0 111.419 -179.152 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.407 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.4 OUTLIER -56.82 -31.77 65.04 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.732 -179.019 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.697 ' HG3' HD11 ' A' ' 693' ' ' ILE . 37.0 mmt180 -50.63 -31.11 15.12 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 697' ' ' ILE . . . . . 0.551 HG22 ' O ' ' B' ' 694' ' ' GLY . 19.0 tt -59.42 -41.1 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 N-CA-C 113.129 0.788 . . . . 0.0 113.129 -175.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 698' ' ' VAL . . . . . 0.522 ' O ' HG22 ' B' ' 701' ' ' VAL . 8.5 p -56.43 -28.72 27.09 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.787 0 CA-C-N 118.474 0.579 . . . . 0.0 111.932 -178.576 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -55.52 -25.79 39.35 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -50.12 -35.6 26.42 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 701' ' ' VAL . . . . . 0.522 HG22 ' O ' ' B' ' 698' ' ' VAL . 33.3 m -59.85 -33.38 52.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.595 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 21.2 tp -61.65 -28.06 69.11 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.314 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 17.3 m -57.98 -34.2 69.71 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 120.971 -0.292 . . . . 0.0 111.571 -179.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 14.3 tp -77.93 -42.33 33.4 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.748 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 48.8 t -66.3 -13.58 16.25 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.345 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -60.84 -34.2 74.2 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.973 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 -76.13 -35.68 59.15 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.049 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.516 ' O ' HG12 ' B' ' 708' ' ' VAL . 16.6 t -89.1 26.07 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.521 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -60.15 116.38 4.16 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.554 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.702 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 660' ' ' LEU . . . . . 0.654 ' HG ' ' HB2' ' B' ' 667' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 5.7 mt -117.39 151.55 36.8 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.013 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -174.0 -177.9 1.42 Allowed 'General case' 0 C--O 1.22 -0.493 0 O-C-N 123.306 0.379 . . . . 0.0 110.186 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.65 -40.13 86.68 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 120.873 0.368 . . . . 0.0 110.454 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.35 -28.99 66.69 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.56 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 32.9 tptt -70.11 -43.29 71.34 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.849 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 666' ' ' TRP . . . . . 0.485 ' NE1' HD22 ' A' ' 661' ' ' LEU . 88.0 m95 -73.04 -49.16 30.27 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.088 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 667' ' ' ALA . . . . . 0.718 ' HB2' ' CD1' ' A' ' 660' ' ' LEU . . . -62.18 -14.73 40.55 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.664 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 60.3 p -65.71 -31.69 72.83 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.533 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 669' ' ' LEU . . . . . 0.461 HD23 HD11 ' C' ' 675' ' ' ILE . 8.6 mp -77.51 -6.06 52.23 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -72.12 -28.55 63.34 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -62.72 -49.89 73.25 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 118.633 -1.227 . . . . 0.0 110.756 -178.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 672' ' ' TRP . . . . . 0.418 ' O ' ' N ' ' C' ' 674' ' ' ASP . 6.1 p90 -95.86 -23.35 16.95 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 51.6 p90 38.66 19.12 0.0 OUTLIER 'General case' 0 C--N 1.363 1.168 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 674' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' C' ' 672' ' ' TRP . 1.0 OUTLIER -64.19 -54.0 40.48 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.448 179.855 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 675' ' ' ILE . . . . . 0.466 ' C ' HD12 ' C' ' 675' ' ' ILE . 1.5 pp -70.15 -33.56 55.32 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 CA-C-O 121.159 0.504 . . . . 0.0 110.491 177.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 21.0 m -58.64 -33.95 70.64 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.796 -177.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -59.9 -47.94 83.73 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 119.481 -0.888 . . . . 0.0 109.961 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 678' ' ' TRP . . . . . 0.525 ' HD1' HD11 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -73.43 -46.05 50.86 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.121 178.728 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 2.5 tt -67.62 -33.44 74.98 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 7.5 t90 -80.12 -17.27 53.01 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.4 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -93.03 -6.43 48.27 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.519 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 682' ' ' ILE . . . . . 0.58 ' O ' HD13 ' C' ' 686' ' ' ILE . 50.2 mm -56.04 -47.6 80.06 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -58.08 -42.01 84.68 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.3 178.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 41.4 mm -61.2 -48.53 88.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.861 -178.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.691 ' HA ' HD12 ' C' ' 688' ' ' ILE . 11.7 m-85 -69.63 -28.87 66.28 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.58 HD13 ' O ' ' C' ' 682' ' ' ILE . 1.2 mp -58.25 -50.04 79.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.584 -178.437 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 40.5 mt -59.08 -41.36 83.24 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.584 0 C-N-CA 120.36 -0.536 . . . . 0.0 109.629 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' C' ' 685' ' ' PHE . 84.1 mt -56.67 -41.88 75.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.88 -31.41 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.6 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.88 -43.44 92.54 Favored Glycine 0 CA--C 1.537 1.417 0 CA-C-N 119.147 0.885 . . . . 0.0 111.66 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 11.8 m -78.59 -20.31 50.77 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 117.501 0.651 . . . . 0.0 112.122 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.5 tp -59.72 -32.95 71.01 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.096 -178.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.2 pp -65.47 -36.47 77.75 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.38 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.68 -36.84 87.91 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 120.74 -0.743 . . . . 0.0 111.489 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 7.8 tt -56.42 -32.83 65.24 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 117.481 0.64 . . . . 0.0 111.156 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.84 -36.68 38.84 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 120.371 0.129 . . . . 0.0 111.28 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 53.5 mt -59.82 -42.03 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.175 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.544 ' O ' HG12 ' C' ' 701' ' ' VAL . 39.4 t -70.91 -33.5 52.33 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.228 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 699' ' ' PHE . . . . . 0.437 ' O ' HD23 ' C' ' 702' ' ' LEU . 0.1 OUTLIER -57.9 -35.48 71.1 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.816 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.73 -35.0 65.66 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 701' ' ' VAL . . . . . 0.544 HG12 ' O ' ' C' ' 698' ' ' VAL . 7.0 p -59.15 -31.83 46.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 119.989 -0.685 . . . . 0.0 111.389 -178.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 702' ' ' LEU . . . . . 0.437 HD23 ' O ' ' C' ' 699' ' ' PHE . 1.3 pp -58.96 -25.1 63.25 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.672 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 26.1 p -57.86 -40.38 80.02 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.052 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 14.7 tp -59.02 -31.43 68.82 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 120.523 -0.471 . . . . 0.0 109.786 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.7 t -81.09 -38.14 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.976 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -61.1 -8.55 3.52 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -178.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 3.0 ppt_? -81.76 -14.67 56.15 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 45.2 t -83.0 -36.18 12.78 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.262 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 21.2 ptt-85 -153.74 173.25 16.09 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.771 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 10.7 tp-100 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.305 179.866 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 660' ' ' LEU . . . . . 0.498 ' C ' HD12 ' A' ' 661' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.941 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 661' ' ' LEU . . . . . 0.698 HD11 ' C9 ' ' A' ' 801' ' ' QOJ . 10.5 mp -118.76 136.15 54.13 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.662 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -141.98 152.29 43.31 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.072 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.3 tt -61.7 -39.84 92.9 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.141 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -26.27 62.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.618 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 19.1 tptt -70.49 -46.11 64.37 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-O 120.852 0.358 . . . . 0.0 111.182 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 64.1 m95 -71.82 -47.67 51.61 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.142 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 667' ' ' ALA . . . . . 0.594 ' HB2' ' HG ' ' B' ' 660' ' ' LEU . . . -59.54 -39.3 83.51 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 120.305 -0.558 . . . . 0.0 111.608 -178.697 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 20.5 t -58.4 -32.03 68.24 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.895 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 669' ' ' LEU . . . . . 0.656 HD21 HG22 ' A' ' 675' ' ' ILE . 2.9 tm? -60.15 -25.01 65.18 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.211 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -68.43 -3.11 10.2 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.915 -0.564 . . . . 0.0 112.24 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -74.85 -50.09 18.25 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 119.128 -1.029 . . . . 0.0 112.6 -178.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 672' ' ' TRP . . . . . 0.411 ' H ' ' HD1' ' A' ' 672' ' ' TRP . 1.0 OUTLIER -104.96 -9.86 17.64 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 118.619 0.645 . . . . 0.0 111.798 177.2 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 1.5 t80 52.06 17.17 0.64 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 176.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 674' ' ' ASP . . . . . 0.406 ' HB2' ' CE3' ' A' ' 672' ' ' TRP . 35.4 t70 -63.73 -52.74 59.13 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.044 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 675' ' ' ILE . . . . . 0.656 HG22 HD21 ' A' ' 669' ' ' LEU . 0.4 OUTLIER -68.38 -34.61 66.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 119.486 -0.886 . . . . 0.0 111.699 -178.384 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 676' ' ' THR . . . . . 0.496 ' OG1' HD11 ' A' ' 669' ' ' LEU . 0.0 OUTLIER -58.95 -33.78 71.02 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.121 -179.185 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.38 -46.79 87.68 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.153 -178.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -72.9 -46.46 52.54 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 679' ' ' LEU . . . . . 0.455 HD12 HD12 ' A' ' 675' ' ' ILE . 96.2 mt -84.61 -19.74 32.51 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -174.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -83.91 13.57 4.81 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.728 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -130.7 -35.48 1.46 Allowed 'General case' 0 C--N 1.35 0.62 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 682' ' ' ILE . . . . . 0.496 ' O ' HD13 ' A' ' 682' ' ' ILE . 0.0 OUTLIER -55.57 -36.77 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.057 178.629 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -60.18 -48.78 80.29 Favored 'General case' 0 C--N 1.349 0.553 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.14 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.32 -43.32 97.94 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 685' ' ' PHE . . . . . 0.603 ' O ' HG23 ' A' ' 689' ' ' VAL . 10.1 t80 -52.74 -27.67 18.78 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 686' ' ' ILE . . . . . 0.711 ' CD1' HG21 ' C' ' 686' ' ' ILE . 38.7 mm -57.64 -51.57 68.32 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.236 -177.034 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 687' ' ' ILE . . . . . 0.491 ' H ' HD12 ' A' ' 687' ' ' ILE . 4.2 mp -61.77 -41.65 91.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.253 179.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 90.6 mt -56.54 -40.34 67.81 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.438 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 689' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 685' ' ' PHE . 57.5 t -67.12 -2.14 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 119.905 -0.718 . . . . 0.0 111.22 -177.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -73.99 -49.36 13.36 Favored Glycine 0 C--N 1.349 1.252 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 35.4 m -66.47 -22.48 66.2 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.925 178.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.79 -32.93 54.35 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.312 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 693' ' ' ILE . . . . . 0.454 HG22 HG21 ' C' ' 693' ' ' ILE . 1.3 pp -80.58 -35.62 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.238 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.2 -45.5 95.9 Favored Glycine 0 C--N 1.342 0.911 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.748 ' O ' HG22 ' A' ' 698' ' ' VAL . 1.6 tt -56.57 -42.17 78.17 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 696' ' ' ARG . . . . . 0.456 ' HE ' HD12 ' C' ' 693' ' ' ILE . 54.0 mmt-85 -50.74 -33.92 24.99 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 122.702 0.401 . . . . 0.0 112.001 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 66.9 mt -56.95 -39.98 69.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.765 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 698' ' ' VAL . . . . . 0.748 HG22 ' O ' ' A' ' 695' ' ' LEU . 17.1 m -55.48 -28.19 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 118.874 0.761 . . . . 0.0 110.787 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -57.95 -36.68 72.88 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.678 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.05 -50.44 73.72 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.931 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 701' ' ' VAL . . . . . 0.447 HG12 ' O ' ' A' ' 698' ' ' VAL . 7.6 p -67.2 -36.97 78.25 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.97 -25.75 67.07 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 1.3 m -57.97 -44.36 87.02 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 121.163 -0.215 . . . . 0.0 110.89 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 3.6 tt -73.24 -27.77 61.77 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.096 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 66.2 t -60.87 -29.47 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -60.75 -17.55 49.36 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.421 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 707' ' ' ARG . . . . . 0.44 ' CZ ' ' CZ ' ' C' ' 707' ' ' ARG . 0.0 OUTLIER -73.85 -34.72 64.63 Favored 'General case' 0 C--O 1.219 -0.521 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.799 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 22.0 t -82.82 -26.74 8.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.331 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 66.29 111.49 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 45.1 tp60 . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.414 179.875 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 660' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' A' ' 667' ' ' ALA . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 661' ' ' LEU . . . . . 0.429 ' H ' HD12 ' B' ' 661' ' ' LEU . 8.1 mp -50.47 135.53 22.25 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 121.199 -0.2 . . . . 0.0 110.775 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -157.27 164.42 37.68 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 120.547 -0.461 . . . . 0.0 111.583 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.6 tt -56.08 -40.57 73.81 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.106 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -74.28 -29.41 61.65 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.041 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 665' ' ' LYS . . . . . 0.415 ' O ' HD13 ' B' ' 669' ' ' LEU . 1.1 tmtp? -61.11 -44.29 97.57 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.332 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -69.94 -51.14 35.29 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.8 -23.52 61.58 Favored 'General case' 0 C--O 1.217 -0.633 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 10.5 m -66.11 -31.78 72.84 Favored 'General case' 0 C--O 1.218 -0.582 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.368 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 669' ' ' LEU . . . . . 0.415 HD13 ' O ' ' B' ' 665' ' ' LYS . 4.7 mp -64.74 -22.03 66.89 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.788 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 24.5 m95 -68.7 -9.04 48.01 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -89.11 -47.64 7.96 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -103.14 -12.96 16.99 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 118.496 2.776 . . . . 0.0 118.496 -174.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 673' ' ' PHE . . . . . 0.463 ' HB3' HG22 ' B' ' 675' ' ' ILE . 1.4 t80 -156.75 156.31 33.11 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 122.914 2.597 . . . . 0.0 117.309 -178.212 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -63.54 -29.42 70.69 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 112.583 -2.098 . . . . 0.0 112.274 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 675' ' ' ILE . . . . . 0.463 HG22 ' HB3' ' B' ' 673' ' ' PHE . 7.2 tp -55.11 -27.0 18.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.58 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -176.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 11.7 m -58.59 -38.95 79.02 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.67 -36.2 70.56 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.381 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 678' ' ' TRP . . . . . 0.458 ' CE3' HD11 ' B' ' 675' ' ' ILE . 34.9 t90 -55.79 -39.76 71.74 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 116.749 -0.205 . . . . 0.0 110.574 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.56 -14.99 59.97 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 680' ' ' TRP . . . . . 0.478 ' HZ3' ' HH ' ' B' ' 681' ' ' TYR . 16.8 t90 -101.84 -4.78 25.71 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -179.106 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 681' ' ' TYR . . . . . 0.478 ' HH ' ' HZ3' ' B' ' 680' ' ' TRP . 59.8 m-85 -125.7 -2.25 7.29 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 120.328 -0.549 . . . . 0.0 112.108 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 7.1 tp -68.07 -40.39 83.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.999 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -60.35 -43.77 96.16 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.874 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 78.0 mt -68.2 -41.8 84.26 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.594 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -52.98 -28.65 24.84 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.544 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 686' ' ' ILE . . . . . 0.787 HG21 HD12 ' C' ' 686' ' ' ILE . 21.6 mm -59.32 -42.78 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.539 -179.295 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.4 mt -58.3 -41.78 82.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 688' ' ' ILE . . . . . 0.51 ' N ' HD12 ' B' ' 688' ' ' ILE . 3.0 mp -62.05 -42.01 93.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 689' ' ' VAL . . . . . 0.629 ' O ' HD11 ' B' ' 692' ' ' LEU . 59.3 t -68.89 -0.99 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.324 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -104.93 7.09 44.33 Favored Glycine 0 CA--C 1.541 1.712 0 C-N-CA 120.634 -0.793 . . . . 0.0 111.902 179.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 3.2 m -88.53 -34.35 17.43 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 117.374 0.587 . . . . 0.0 111.348 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 692' ' ' LEU . . . . . 0.629 HD11 ' O ' ' B' ' 689' ' ' VAL . 0.2 OUTLIER -65.3 -32.69 74.48 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.663 -178.71 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 693' ' ' ILE . . . . . 0.822 HD11 ' HG3' ' C' ' 696' ' ' ARG . 0.8 OUTLIER -57.26 -46.16 85.01 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.37 -178.912 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -71.2 -41.66 59.38 Favored Glycine 0 CA--C 1.532 1.111 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 178.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 695' ' ' LEU . . . . . 0.428 ' C ' HD23 ' B' ' 695' ' ' LEU . 10.5 tt -56.58 -34.9 67.61 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.595 -0.302 . . . . 0.0 111.438 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 696' ' ' ARG . . . . . 0.43 HH11 HD13 ' B' ' 693' ' ' ILE . 11.7 mtm105 -50.69 -31.59 16.86 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 42.3 mm -59.62 -41.34 84.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.33 -28.66 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -56.03 -29.21 60.07 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 120.214 -0.594 . . . . 0.0 111.678 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -51.43 -35.92 41.54 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.776 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 79.7 t -60.43 -32.3 50.84 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.851 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.28 -25.82 67.81 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.257 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 23.2 t -57.44 -37.42 72.79 Favored 'General case' 0 C--O 1.22 -0.492 0 C-N-CA 121.14 -0.224 . . . . 0.0 111.24 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 26.0 tp -64.62 -31.47 72.71 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.029 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 22.0 t -88.1 -21.94 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.035 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.04 -25.78 67.16 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.754 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 68.1 mtp85 -73.7 -49.84 23.79 Favored 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 120.614 -0.434 . . . . 0.0 111.114 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 708' ' ' VAL . . . . . 0.529 ' O ' HG12 ' B' ' 708' ' ' VAL . 18.1 t -104.54 26.1 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.545 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -53.92 146.83 13.34 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.628 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.488 179.771 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 50.67 -176.0 0.02 OUTLIER 'General case' 0 C--O 1.215 -0.721 0 CA-C-O 120.615 0.245 . . . . 0.0 111.558 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -159.87 158.84 31.64 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 663' ' ' LEU . . . . . 0.489 HD21 ' HB2' ' A' ' 660' ' ' LEU . 1.7 tm? -62.65 -40.73 97.96 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.245 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -74.53 -24.24 58.94 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.982 178.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -66.84 -39.5 87.63 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.12 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -60.25 -47.97 83.73 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.233 -0.587 . . . . 0.0 110.067 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.34 -29.35 70.39 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.73 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 19.3 t -64.41 -34.18 77.59 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.162 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 6.1 mp -68.68 -4.66 16.49 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -70.77 -28.81 64.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -62.63 -49.64 74.4 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.934 -177.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 672' ' ' TRP . . . . . 0.428 ' O ' ' N ' ' C' ' 674' ' ' ASP . 2.4 p90 -92.93 -22.67 19.08 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 115.635 1.717 . . . . 0.0 115.635 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 20.4 p90 43.28 8.86 0.0 OUTLIER 'General case' 0 C--N 1.359 1.015 0 N-CA-C 115.648 1.721 . . . . 0.0 115.648 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 674' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' C' ' 672' ' ' TRP . 9.2 t70 -64.24 -53.81 43.22 Favored 'General case' 0 C--N 1.349 0.586 0 CA-C-N 120.007 1.276 . . . . 0.0 110.63 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 7.8 tp -69.76 -33.22 55.22 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.718 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.243 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 13.4 m -58.85 -41.89 88.05 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -177.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -63.22 -43.66 97.47 Favored 'General case' 0 C--O 1.213 -0.829 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.297 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 3.1 t90 -72.51 -45.88 57.28 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.62 -27.03 55.57 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -92.93 7.91 42.0 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.52 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -137.51 3.68 2.56 Favored 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 120.507 -0.477 . . . . 0.0 111.858 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 3.9 tp -64.19 -41.89 93.81 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.063 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 4.6 ptt-85 -58.25 -43.45 87.87 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.159 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 82.5 mt -68.23 -39.87 81.82 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 177.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 685' ' ' PHE . . . . . 0.539 ' HA ' HD12 ' C' ' 688' ' ' ILE . 0.4 OUTLIER -53.39 -28.86 31.74 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.07 -179.6 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 686' ' ' ILE . . . . . 0.787 HD12 HG21 ' B' ' 686' ' ' ILE . 24.0 mm -59.78 -44.29 93.6 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.518 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.843 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 54.7 mt -58.22 -41.51 81.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.539 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 688' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' C' ' 685' ' ' PHE . 31.3 mt -57.59 -41.86 80.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.253 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 31.2 t -67.96 -31.23 51.11 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 CA-C-O 119.021 -0.514 . . . . 0.0 111.736 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -67.08 -62.22 4.62 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 119.132 0.878 . . . . 0.0 111.001 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.3 m -51.63 -22.27 3.24 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 116.9 0.35 . . . . 0.0 111.405 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 tp -57.46 -32.85 67.36 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.127 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 693' ' ' ILE . . . . . 0.456 HD12 ' HE ' ' A' ' 696' ' ' ARG . 1.2 pt -73.63 -24.86 20.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.392 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.81 -55.13 30.22 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.865 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 695' ' ' LEU . . . . . 0.658 HD23 ' O ' ' C' ' 695' ' ' LEU . 2.1 tt -56.83 -31.96 65.26 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 117.044 0.422 . . . . 0.0 111.945 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 696' ' ' ARG . . . . . 0.822 ' HG3' HD11 ' B' ' 693' ' ' ILE . 6.9 mmt180 -50.57 -34.34 25.34 Favored 'General case' 0 C--O 1.212 -0.885 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 697' ' ' ILE . . . . . 0.715 ' O ' HD13 ' C' ' 697' ' ' ILE . 0.2 OUTLIER -57.66 -40.43 75.33 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 CA-C-O 118.688 -0.673 . . . . 0.0 112.427 -175.361 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 698' ' ' VAL . . . . . 0.499 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.8 p -55.92 -29.2 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 CA-C-N 119.502 1.046 . . . . 0.0 111.185 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 699' ' ' PHE . . . . . 0.417 ' HB2' ' O ' ' C' ' 696' ' ' ARG . 0.3 OUTLIER -56.71 -34.42 67.45 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.722 179.449 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.72 -35.25 63.47 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 119.294 -0.384 . . . . 0.0 111.573 -176.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.68 -32.16 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 120.001 -0.68 . . . . 0.0 109.836 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.26 -28.8 67.06 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.496 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.0 t -63.48 -38.41 91.04 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.364 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 704' ' ' LEU . . . . . 0.432 HD11 ' HE ' ' A' ' 707' ' ' ARG . 15.0 tp -54.9 -30.98 59.59 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.083 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 41.3 t -75.44 -26.44 18.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.41 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -60.65 -16.93 43.99 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 707' ' ' ARG . . . . . 0.44 ' CZ ' ' CZ ' ' A' ' 707' ' ' ARG . 6.7 ptm180 -74.94 -32.38 61.73 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.276 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 35.4 t -82.79 -30.1 8.69 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.187 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 11.5 tpt85 55.13 -85.71 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.916 0 CA-C-O 119.264 -0.398 . . . . 0.0 111.958 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 . . . . . 0 C--N 1.346 0.426 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.455 -179.615 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 801' ' ' QOJ . . . . . 0.698 ' C9 ' HD11 ' A' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.783 HD11 ' CZ2' ' A' ' 666' ' ' TRP . 12.1 tp -171.22 144.93 2.12 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.339 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -161.59 148.85 14.6 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.261 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.816 HD13 ' N ' ' A' ' 664' ' ' ASP . 0.0 OUTLIER -54.73 -19.73 6.89 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.584 179.156 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . 0.816 ' N ' HD13 ' A' ' 663' ' ' LEU . 9.3 t70 -75.1 -37.56 61.45 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.314 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -68.94 -39.6 79.48 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.784 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . 0.783 ' CZ2' HD11 ' A' ' 661' ' ' LEU . 75.4 m95 -68.24 -49.74 58.65 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.263 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.42 -40.58 77.17 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.128 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 26.1 t -60.93 -35.69 77.37 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.846 178.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.402 HD22 ' CG2' ' A' ' 675' ' ' ILE . 6.6 mt -57.58 -19.88 28.62 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.331 179.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -68.64 -2.84 9.99 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -64.24 -48.94 73.89 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.37 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.6 -23.12 13.51 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.409 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 54.37 1.71 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -63.92 -53.53 48.9 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 119.217 0.917 . . . . 0.0 111.722 -179.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.516 HD11 ' CE3' ' A' ' 678' ' ' TRP . 8.8 tp -69.28 -32.11 52.35 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.27 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 18.5 m -58.5 -39.13 79.2 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.951 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -60.35 -41.17 93.06 Favored 'General case' 0 C--O 1.211 -0.923 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.516 ' CE3' HD11 ' A' ' 675' ' ' ILE . 76.5 t90 -71.97 -22.16 61.48 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.974 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.96 -16.46 35.75 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.69 26.44 5.59 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 119.963 -0.695 . . . . 0.0 112.329 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -130.37 -41.14 1.24 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 10.6 tt -66.53 -36.97 78.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.999 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -48.38 76.78 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 36.9 mt -60.19 -37.45 73.43 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.899 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.472 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.2 OUTLIER -52.11 -28.71 18.72 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.861 -178.032 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.718 HD11 ' CG2' ' C' ' 686' ' ' ILE . 1.4 mp -58.68 -50.52 78.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.948 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 58.1 mt -58.22 -42.01 82.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.592 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 88.5 mt -58.88 -41.17 82.1 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 685' ' ' PHE . 92.3 t -67.37 -17.96 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.018 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.13 -65.04 3.54 Favored Glycine 0 C--N 1.35 1.328 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 178.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 48.7 m -54.51 -29.51 50.63 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.772 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.9 tp -55.75 -41.77 74.45 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.926 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.629 HD12 ' HG3' ' B' ' 696' ' ' ARG . 0.3 OUTLIER -71.03 -37.08 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.114 -179.255 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.73 -40.6 98.68 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 110.124 -1.191 . . . . 0.0 110.124 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.606 ' O ' HD23 ' A' ' 695' ' ' LEU . 3.2 tt -56.44 -31.66 64.15 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-O 120.655 0.265 . . . . 0.0 111.549 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 42.1 mmt-85 -50.45 -34.56 25.2 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . 0.511 HD12 ' N ' ' A' ' 698' ' ' VAL . 2.4 pp -57.48 -40.38 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -175.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 695' ' ' LEU . 18.9 m -55.81 -28.33 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 119.263 -0.975 . . . . 0.0 110.965 -178.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -55.65 -36.27 66.85 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.038 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.85 -47.64 79.9 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 63.1 t -66.04 -44.54 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . 0.547 ' O ' HG12 ' A' ' 705' ' ' VAL . 5.8 tt -62.85 -29.51 70.8 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.928 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 35.4 t -64.41 -42.66 95.96 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.9 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.482 HD11 ' HD3' ' C' ' 707' ' ' ARG . 7.6 tp -80.1 -30.03 39.11 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.072 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.547 HG12 ' O ' ' A' ' 702' ' ' LEU . 0.5 OUTLIER -60.77 -22.67 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.542 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -60.72 -24.68 65.86 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.665 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -73.7 -11.59 60.45 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.038 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 61.9 t -107.34 -36.13 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 53.6 ttm-85 -127.91 145.62 50.89 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.65 -179.836 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 N--CA 1.497 1.914 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.678 HD21 ' CD1' ' A' ' 666' ' ' TRP . 1.2 pt? -162.84 150.61 13.66 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -167.44 -175.87 3.02 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.442 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.454 HD21 HD13 ' C' ' 660' ' ' LEU . 10.6 tt -53.55 -40.14 65.3 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.501 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -74.35 -30.63 62.09 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.481 0.488 . . . . 0.0 112.044 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 5.4 tptp -70.37 -46.36 64.23 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -66.92 -39.64 87.42 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.366 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.25 -23.36 67.03 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.742 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -31.97 73.21 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.533 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 61.1 mt -77.45 -4.22 44.33 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 10.7 m0 -68.62 -5.19 18.63 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -89.11 -49.78 6.55 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 119.208 -0.997 . . . . 0.0 111.238 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . 0.423 ' O ' ' N ' ' B' ' 674' ' ' ASP . 1.2 p90 -104.27 -23.62 13.21 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.918 177.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 53.6 p90 34.5 25.73 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.401 1.259 . . . . 0.0 114.401 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' B' ' 672' ' ' TRP . 72.5 m-20 -63.65 -53.08 56.98 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 119.786 -0.765 . . . . 0.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tp -69.1 -31.58 50.72 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.05 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.1 m -58.8 -36.4 74.4 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.681 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -60.49 -45.9 92.06 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.595 -0.442 . . . . 0.0 109.817 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -70.83 -45.97 63.58 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.534 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 75.6 mt -67.35 -2.79 6.66 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 119.939 -0.704 . . . . 0.0 111.795 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.3 t90 -117.69 142.78 46.85 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 72.6 13.27 5.34 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -36.35 61.16 Favored 'Isoleucine or valine' 0 C--N 1.354 0.764 0 CA-C-N 119.585 1.084 . . . . 0.0 110.419 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.8 mtm105 -55.43 -43.76 75.65 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.904 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 88.2 mt -60.45 -42.75 92.28 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.753 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -55.81 -43.78 77.24 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.32 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.502 HG21 HD11 ' C' ' 686' ' ' ILE . 1.9 mp -59.75 -40.52 82.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 120.267 -0.573 . . . . 0.0 109.644 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 90.8 mt -58.77 -41.53 82.83 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.482 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 26.0 mm -58.75 -43.94 89.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 61.3 t -68.45 -9.51 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.161 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -78.08 -39.1 24.55 Favored Glycine 0 C--N 1.351 1.389 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 16.5 m -80.9 -19.83 43.49 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.802 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.82 -40.93 94.58 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.901 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.57 HD11 ' HG2' ' C' ' 696' ' ' ARG . 0.8 OUTLIER -60.19 -40.4 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.579 -179.007 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -68.3 -43.66 78.3 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 119.566 -1.302 . . . . 0.0 111.238 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.492 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.2 OUTLIER -56.92 -38.54 73.02 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 116.906 0.353 . . . . 0.0 111.481 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.629 ' HG3' HD12 ' A' ' 693' ' ' ILE . 25.4 mmt180 -50.77 -30.17 13.4 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 44.8 mm -58.24 -39.85 75.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 119.435 -0.317 . . . . 0.0 111.225 -176.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.658 ' O ' HG22 ' B' ' 701' ' ' VAL . 6.4 p -54.97 -26.95 18.33 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 C-N-CA 120.614 -0.435 . . . . 0.0 111.007 -179.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -54.29 -24.8 20.41 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.57 -34.9 18.93 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 121.337 -0.145 . . . . 0.0 111.092 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . 0.658 HG22 ' O ' ' B' ' 698' ' ' VAL . 35.2 m -59.33 -31.34 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.55 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . 0.487 HD23 ' C ' ' B' ' 702' ' ' LEU . 8.9 tt -58.24 -41.62 84.58 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.592 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 26.7 t -64.82 -37.55 87.99 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -55.28 -43.98 75.26 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -176.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 27.1 m -71.1 -10.8 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 120.022 -0.671 . . . . 0.0 112.676 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.58 -14.05 17.81 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 119.427 -0.909 . . . . 0.0 110.84 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -73.95 -24.04 59.59 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 121.281 -0.167 . . . . 0.0 111.171 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 40.2 t -85.28 -36.07 10.58 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.275 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -68.64 -176.38 0.8 Allowed 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.498 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 118.004 -0.998 . . . . 0.0 111.067 179.855 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.454 HD13 HD21 ' B' ' 663' ' ' LEU . 17.7 mt . . . . . 0 N--CA 1.494 1.757 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -85.12 121.87 28.51 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.152 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -162.42 161.43 27.24 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.382 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 8.8 tt -52.91 -40.5 63.62 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.133 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -62.98 -31.87 73.08 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 123.834 0.709 . . . . 0.0 111.616 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -69.79 -41.17 75.44 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.047 -179.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -61.92 -49.33 76.61 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.449 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.54 -31.87 72.86 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.431 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 7.6 t -67.88 -32.68 73.33 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.604 0.24 . . . . 0.0 111.184 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . 0.545 HD11 HG22 ' C' ' 675' ' ' ILE . 11.2 tp -57.66 -15.86 8.93 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.284 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -68.7 -2.61 9.63 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 118.981 -0.533 . . . . 0.0 112.35 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -65.03 -50.39 66.45 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 119.318 -0.953 . . . . 0.0 112.995 -177.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . 0.411 ' CE3' ' HB2' ' C' ' 674' ' ' ASP . 12.9 p-90 -103.81 6.17 36.45 Favored 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 56.6 -29.39 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 118.943 2.942 . . . . 0.0 118.943 175.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . 0.411 ' HB2' ' CE3' ' C' ' 672' ' ' TRP . 0.3 OUTLIER -63.61 -54.6 33.38 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 121.519 1.963 . . . . 0.0 113.336 -175.015 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.657 HG23 HD23 ' C' ' 679' ' ' LEU . 1.6 mm -69.75 -27.77 34.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 119.119 -1.032 . . . . 0.0 110.113 177.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 18.8 m -58.55 -49.82 76.03 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -70.15 -42.79 72.08 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -69.19 -26.48 64.86 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.657 HD23 HG23 ' C' ' 675' ' ' ILE . 0.7 OUTLIER -69.69 -32.93 71.82 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -178.388 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -126.58 18.43 7.44 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 114.495 1.295 . . . . 0.0 114.495 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -125.28 0.27 7.73 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.98 177.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 7.0 tp -68.56 -36.16 73.42 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 120.599 0.237 . . . . 0.0 111.524 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.07 -37.14 66.38 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.026 -0.533 . . . . 0.0 112.125 -176.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.416 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.8 mp -63.95 -48.66 85.11 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.828 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -59.22 -30.13 68.02 Favored 'General case' 0 C--O 1.218 -0.575 0 O-C-N 123.387 0.429 . . . . 0.0 111.093 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.718 ' CG2' HD11 ' A' ' 686' ' ' ILE . 1.0 OUTLIER -58.89 -46.0 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.116 -179.272 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 63.8 mt -60.17 -41.68 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.823 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.567 ' H ' HD12 ' C' ' 688' ' ' ILE . 3.5 mp -57.05 -40.89 75.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 51.2 t -66.95 -17.6 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 119.844 -0.742 . . . . 0.0 111.431 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -70.32 -62.8 3.52 Favored Glycine 0 C--N 1.351 1.384 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.05 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 4.5 m -51.85 -25.39 7.77 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 117.365 0.583 . . . . 0.0 112.01 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.4 tp -53.77 -34.3 58.62 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.001 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.455 HD12 ' C ' ' C' ' 693' ' ' ILE . 1.7 pp -79.18 -33.32 15.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.787 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.937 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.92 -48.54 85.11 Favored Glycine 0 CA--C 1.543 1.795 0 C-N-CA 120.68 -0.771 . . . . 0.0 111.691 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.549 HD13 ' C ' ' C' ' 695' ' ' LEU . 1.2 tm? -56.57 -31.84 64.62 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -178.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.57 ' HG2' HD11 ' B' ' 693' ' ' ILE . 0.4 OUTLIER -50.5 -34.19 24.17 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.78 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 20.0 tt -57.64 -41.22 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-O 118.639 -0.696 . . . . 0.0 112.681 -174.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.661 ' O ' HG22 ' C' ' 701' ' ' VAL . 5.6 p -56.49 -28.87 27.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.028 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -34.84 69.7 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.303 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.75 -34.83 63.05 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -175.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . 0.661 HG22 ' O ' ' C' ' 698' ' ' VAL . 35.4 m -59.15 -31.24 45.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.459 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tt -58.64 -27.89 65.15 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.834 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 19.6 m -58.43 -38.33 77.21 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.497 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 14.2 tp -59.43 -35.23 73.64 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.441 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 9.9 t -84.9 -17.87 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.289 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.24 -25.92 66.02 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . 0.482 ' HD3' HD11 ' A' ' 704' ' ' LEU . 34.2 mtm105 -73.85 -45.78 48.99 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.96 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 45.3 t -88.61 -12.59 10.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.254 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.219 -0.508 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.416 HD12 HD11 ' C' ' 663' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.842 0 CA-C-O 119.695 -0.193 . . . . 0.0 110.96 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.478 ' N ' HD12 ' A' ' 661' ' ' LEU . 7.6 mp 55.88 177.87 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.527 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -169.92 147.7 3.36 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.269 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.1 tt -61.65 -40.24 94.21 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.528 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -73.98 -23.95 59.54 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.491 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 15.2 tmtt? -64.88 -42.16 95.03 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 121.059 -0.257 . . . . 0.0 111.136 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . 0.565 ' HE1' HD22 ' B' ' 661' ' ' LEU . 91.5 m95 -69.1 -53.27 21.15 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.328 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.55 84.89 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.875 -178.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 40.4 t -58.75 -31.77 68.63 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.743 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 679' ' ' LEU . 47.7 tp -58.73 -25.68 63.19 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.306 -178.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -68.29 -5.55 19.18 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 119.045 -1.062 . . . . 0.0 111.429 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -63.1 -40.31 97.27 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.972 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . 0.447 ' HB2' HG22 ' A' ' 675' ' ' ILE . 6.5 m95 -83.42 -22.75 32.59 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.591 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 42.9 t80 64.99 -67.25 0.12 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -56.04 -52.73 63.2 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.584 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -68.58 -28.42 40.13 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.767 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.477 -179.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.0 m -58.97 -46.39 88.18 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.882 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -62.35 -47.38 84.48 Favored 'General case' 0 C--O 1.213 -0.824 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.737 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -64.88 -37.46 87.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.784 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.407 HD23 ' CD2' ' A' ' 669' ' ' LEU . 8.5 tp -67.98 -8.86 40.88 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.3 t-105 -139.3 0.86 1.94 Allowed 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -102.5 0.42 33.59 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 119.889 -0.724 . . . . 0.0 112.125 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.619 HD12 ' N ' ' A' ' 683' ' ' ARG . 2.8 pp -55.93 -36.84 45.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.628 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.283 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.619 ' N ' HD12 ' A' ' 682' ' ' ILE . 2.1 tmm_? -67.48 -48.51 66.93 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.946 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 86.3 mt -62.74 -43.67 98.87 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.921 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -52.81 -29.07 25.52 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.781 -179.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.698 HG13 HD12 ' B' ' 686' ' ' ILE . 16.9 mm -58.69 -38.97 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.923 -179.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 10.8 mt -58.01 -41.75 81.08 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 80.8 mt -56.99 -41.28 77.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 177.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 689' ' ' VAL . 43.3 t -68.04 -0.35 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.345 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -81.1 -34.92 25.42 Favored Glycine 0 C--N 1.349 1.272 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 178.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 13.3 m -75.81 -30.74 59.14 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 116.889 0.345 . . . . 0.0 111.101 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.79 -33.12 54.97 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.944 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 1.7 pp -70.58 -37.23 69.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 120.101 -0.64 . . . . 0.0 110.033 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . 0.679 ' O ' HG22 ' A' ' 697' ' ' ILE . . . -59.81 -43.27 98.09 Favored Glycine 0 C--O 1.214 -1.095 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.791 ' O ' HG22 ' A' ' 698' ' ' VAL . 0.2 OUTLIER -56.7 -42.19 78.7 Favored 'General case' 0 C--O 1.211 -0.953 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.553 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -50.48 -35.25 28.24 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . 0.694 HD13 ' O ' ' A' ' 697' ' ' ILE . 0.2 OUTLIER -58.18 -40.19 76.37 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.77 -177.093 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.791 HG22 ' O ' ' A' ' 695' ' ' LEU . 13.2 m -55.82 -28.35 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 118.384 0.538 . . . . 0.0 110.829 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -58.45 -36.54 73.84 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.651 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.9 -50.81 72.06 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.175 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 698' ' ' VAL . 11.1 p -68.83 -32.08 53.29 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.18 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.0 tp -58.77 -27.36 64.91 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.223 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 48.3 t -58.0 -45.32 87.03 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.423 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.3 -40.97 97.02 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.92 -28.39 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.435 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -60.81 -14.8 24.03 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -39.72 63.84 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.435 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.535 ' O ' HG12 ' A' ' 708' ' ' VAL . 28.5 t -105.54 10.43 9.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.532 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 66.54 -76.07 0.05 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 122.237 -0.29 . . . . 0.0 110.531 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.468 179.924 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.423 HD23 ' N ' ' B' ' 661' ' ' LEU . 1.4 tt . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.565 HD22 ' HE1' ' A' ' 666' ' ' TRP . 0.7 OUTLIER 54.13 90.61 0.03 OUTLIER 'General case' 0 C--O 1.22 -0.461 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.933 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -143.79 147.52 34.26 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.398 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.6 HD22 ' C ' ' B' ' 663' ' ' LEU . 0.0 OUTLIER -52.92 -27.4 18.57 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.463 -179.608 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . 0.581 ' H ' HD13 ' B' ' 663' ' ' LEU . 1.3 t70 -74.23 -40.62 62.3 Favored 'General case' 0 C--O 1.22 -0.487 0 O-C-N 123.275 0.359 . . . . 0.0 111.147 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -65.26 -46.09 81.91 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.393 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -64.92 -43.86 91.4 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 120.779 -0.369 . . . . 0.0 111.005 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . 0.666 ' HB2' HD23 ' C' ' 660' ' ' LEU . . . -63.28 -31.0 72.04 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.311 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 34.4 t -55.62 -31.45 62.29 Favored 'General case' 0 C--O 1.219 -0.502 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.892 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.54 HD23 HG23 ' B' ' 675' ' ' ILE . 11.2 mp -71.44 -8.77 56.01 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -74.17 -26.79 60.5 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -63.01 -43.8 97.77 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.563 -178.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.22 -23.17 13.64 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.699 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 14.6 t80 50.42 6.27 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 178.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -63.66 -53.84 45.1 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 119.578 1.081 . . . . 0.0 110.992 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.54 HG23 HD23 ' B' ' 669' ' ' LEU . 7.0 tp -69.67 -29.83 42.65 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.911 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.844 177.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 13.1 m -59.04 -41.24 87.37 Favored 'General case' 0 C--O 1.214 -0.809 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.716 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -62.64 -47.35 84.1 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.268 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.453 ' O ' HG23 ' B' ' 682' ' ' ILE . 3.0 t90 -72.47 -45.48 59.34 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.369 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 8.3 tp -74.47 -29.38 61.42 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 19.1 t90 -86.77 -14.82 41.22 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 120.152 -0.619 . . . . 0.0 112.016 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -103.94 10.81 36.11 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.238 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.453 HG23 ' O ' ' B' ' 678' ' ' TRP . 30.9 pt -62.64 -41.27 91.55 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.3 ttp-105 -63.69 -45.55 89.53 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.749 -0.381 . . . . 0.0 110.734 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.0 -40.08 82.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.526 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.7 OUTLIER -53.38 -30.93 42.32 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.473 -179.229 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.698 HD12 HG13 ' A' ' 686' ' ' ILE . 22.5 mm -59.8 -50.06 81.48 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.136 -179.443 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 73.7 mt -62.12 -42.15 93.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 79.6 mt -60.8 -42.67 93.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.657 ' O ' HD11 ' B' ' 692' ' ' LEU . 87.0 t -68.73 -1.67 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.405 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -105.84 6.71 41.02 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.624 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 38.6 m -88.7 -34.27 17.25 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 117.414 0.607 . . . . 0.0 111.583 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.657 HD11 ' O ' ' B' ' 689' ' ' VAL . 0.2 OUTLIER -61.07 -35.12 76.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.417 -178.669 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.738 HD13 ' O ' ' B' ' 693' ' ' ILE . 0.0 OUTLIER -61.48 -33.54 57.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.956 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . 0.641 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -73.05 -44.06 37.67 Favored Glycine 0 C--O 1.214 -1.103 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 178.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.75 -41.62 77.87 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 121.323 -0.151 . . . . 0.0 110.836 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 28.0 mmt180 -51.03 -31.3 17.93 Favored 'General case' 0 C--O 1.214 -0.773 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.678 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.2 OUTLIER -59.53 -40.68 82.57 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.26 -177.763 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 54.0 t -56.04 -28.21 24.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 119.551 -0.261 . . . . 0.0 110.889 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -55.44 -26.82 44.27 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 120.023 -0.671 . . . . 0.0 111.276 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -53.12 -36.82 61.18 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 120.639 -0.424 . . . . 0.0 109.943 178.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.57 -43.15 98.13 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.534 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.7 tt -63.33 -40.69 98.01 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.578 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.4 t -60.36 -32.75 71.57 Favored 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.287 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.86 -40.19 94.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.86 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.76 -19.5 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.684 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -60.85 -17.72 51.78 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.718 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 8.6 tpp85 -73.9 -41.43 62.13 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 46.1 t -92.21 -36.25 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.152 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 18.8 ttm105 -142.74 151.74 41.59 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.945 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.034 -0.984 . . . . 0.0 111.131 179.871 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.666 HD23 ' HB2' ' B' ' 667' ' ' ALA . 5.2 mp . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.501 HD11 ' HE1' ' C' ' 666' ' ' TRP . 0.3 OUTLIER -85.86 121.01 27.9 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.216 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . 0.47 ' N ' HD13 ' C' ' 661' ' ' LEU . 38.6 tt0 -161.25 162.64 31.18 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.079 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.416 HD11 HD12 ' A' ' 660' ' ' LEU . 9.3 tt -58.03 -40.03 79.84 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.538 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -74.01 -23.95 59.51 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.511 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -44.36 76.08 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.232 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . 0.501 ' HE1' HD11 ' C' ' 661' ' ' LEU . 86.5 m95 -62.67 -49.98 72.98 Favored 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 120.671 -0.412 . . . . 0.0 111.087 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.0 -30.56 59.7 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.509 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.8 m -61.59 -32.32 72.42 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.454 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' C' ' 669' ' ' LEU . 4.5 mm? -67.32 -8.83 35.42 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -68.63 -22.39 64.42 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.758 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.09 -42.65 99.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . 0.531 ' HB2' HG22 ' C' ' 675' ' ' ILE . 2.6 m95 -80.02 -22.75 42.06 Favored 'General case' 0 CA--C 1.558 1.269 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -176.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 63.27 -69.4 0.07 Allowed 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 120.068 1.304 . . . . 0.0 114.204 178.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -50.9 -52.37 42.55 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -176.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.531 HG22 ' HB2' ' C' ' 672' ' ' TRP . 7.3 tp -68.56 -28.49 40.44 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.006 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.6 m -58.81 -43.76 90.64 Favored 'General case' 0 C--O 1.22 -0.475 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.167 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -60.36 -47.02 87.84 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 120.326 -0.549 . . . . 0.0 109.8 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 41.8 t90 -57.55 -41.34 80.81 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.135 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 53.4 mt -73.62 -19.67 60.8 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -112.57 1.8 15.97 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -120.74 -7.9 9.53 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.542 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 8.0 tp -58.51 -36.62 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.998 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 49.3 ttp180 -55.8 -48.2 75.8 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.455 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.456 HD12 ' N ' ' C' ' 684' ' ' ILE . 2.0 mp -67.77 -46.75 81.85 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.572 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.411 ' O ' HG23 ' C' ' 689' ' ' VAL . 5.8 m-85 -52.74 -30.03 30.3 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 123.248 0.343 . . . . 0.0 111.067 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.528 HG23 HD11 ' A' ' 686' ' ' ILE . 1.0 OUTLIER -58.82 -45.79 91.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.496 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 52.7 mt -62.74 -41.65 93.21 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.453 ' N ' HD12 ' C' ' 688' ' ' ILE . 2.1 mp -56.49 -40.89 70.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.737 ' O ' HD12 ' C' ' 692' ' ' LEU . 87.2 t -66.81 -22.17 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.899 -176.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.02 -5.43 87.66 Favored Glycine 0 CA--C 1.555 2.568 0 CA-C-N 119.93 1.241 . . . . 0.0 113.34 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 67.4 m -88.76 -34.5 17.1 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.97 1.385 . . . . 0.0 113.046 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . 0.852 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -53.85 -31.68 50.39 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.049 -178.788 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.852 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.2 OUTLIER -62.05 -33.87 60.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 178.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.73 -37.14 89.3 Favored Glycine 0 CA--C 1.54 1.626 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.496 ' O ' HG23 ' C' ' 698' ' ' VAL . 4.1 tt -56.39 -30.85 63.25 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -49.42 -36.3 21.78 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.517 HD12 ' N ' ' C' ' 698' ' ' VAL . 2.2 pp -59.89 -41.92 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.964 0.802 . . . . 0.0 112.609 -177.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.717 ' O ' HG22 ' C' ' 701' ' ' VAL . 0.0 OUTLIER -61.61 -28.85 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 118.523 -1.271 . . . . 0.0 110.282 -179.293 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . 0.406 ' O ' HD23 ' C' ' 702' ' ' LEU . 1.0 OUTLIER -64.45 -35.54 81.26 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -179.331 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.68 -35.48 66.08 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -176.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . 0.717 HG22 ' O ' ' C' ' 698' ' ' VAL . 34.1 m -59.77 -31.52 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 120.063 -0.655 . . . . 0.0 111.515 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . 0.406 HD23 ' O ' ' C' ' 699' ' ' PHE . 1.5 pp -58.47 -28.77 65.63 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.178 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.3 m -58.04 -41.42 83.22 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.337 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 24.9 tp -62.23 -33.56 74.82 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 23.0 t -69.87 -27.25 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.609 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -60.94 -7.01 2.11 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 64.0 ttt-85 -73.81 -42.51 60.81 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 3.1 t -102.68 26.08 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.673 179.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.687 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.694 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 45.9 mt . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.34 -155.93 0.2 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.083 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 78.25 168.6 0.21 Allowed 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 117.961 0.346 . . . . 0.0 110.706 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 3.4 tt -52.3 -22.57 4.64 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.204 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -69.47 -45.54 68.77 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.322 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -70.4 -41.33 73.15 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.7 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . 0.664 ' CD1' HD13 ' B' ' 661' ' ' LEU . 77.2 m95 -64.56 -38.8 92.27 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.116 -179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.33 78.82 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 120.293 -0.563 . . . . 0.0 112.487 -178.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 11.5 t -57.39 -32.6 66.98 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.144 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.468 HD11 ' CG2' ' A' ' 675' ' ' ILE . 15.3 tp -58.76 -23.1 59.47 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.177 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -79.22 -2.99 43.62 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 118.274 -0.87 . . . . 0.0 112.954 -177.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.23 -50.68 37.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 117.987 -1.485 . . . . 0.0 111.906 -177.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -104.9 -22.13 13.2 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-O 120.714 0.292 . . . . 0.0 110.546 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 47.9 p90 40.22 23.28 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 178.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -62.81 -52.68 62.23 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.51 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.468 ' CG2' HD11 ' A' ' 669' ' ' LEU . 7.4 tp -68.59 -27.35 35.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.685 178.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 25.8 m -58.03 -36.15 72.32 Favored 'General case' 0 C--N 1.347 0.483 0 C-N-CA 120.367 -0.533 . . . . 0.0 109.719 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -59.94 -47.5 85.56 Favored 'General case' 0 C--O 1.219 -0.5 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 177.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.461 ' O ' HG22 ' A' ' 682' ' ' ILE . 76.6 t90 -61.73 -19.86 62.88 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.224 177.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.5 tp -94.03 -8.5 39.68 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 120.362 -0.535 . . . . 0.0 112.011 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -128.33 21.38 6.16 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 120.367 -0.533 . . . . 0.0 112.123 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -132.41 -40.24 1.0 Allowed 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 178.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.566 HD13 ' O ' ' A' ' 682' ' ' ILE . 0.0 OUTLIER -68.07 -38.77 80.34 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.744 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.242 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -59.28 -48.17 82.61 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.528 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -62.06 -45.61 98.35 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.61 ' HA ' HD12 ' A' ' 688' ' ' ILE . 1.0 OUTLIER -52.72 -27.56 18.15 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 179.569 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.82 HG23 HG12 ' C' ' 686' ' ' ILE . 32.7 mm -57.33 -50.52 76.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 C-N-CA 120.161 -0.616 . . . . 0.0 110.581 -177.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 44.0 mt -58.94 -42.03 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 119.614 -0.834 . . . . 0.0 109.854 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . 0.61 HD12 ' HA ' ' A' ' 685' ' ' PHE . 81.8 mt -56.65 -40.91 72.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.483 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 88.8 t -67.25 -16.02 20.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.864 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -72.32 -26.4 72.11 Favored Glycine 0 CA--C 1.539 1.542 0 N-CA-C 110.087 -1.205 . . . . 0.0 110.087 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -86.33 -19.84 29.22 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.671 0.236 . . . . 0.0 111.094 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.39 -40.9 88.08 Favored 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.266 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.763 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.1 OUTLIER -68.53 -33.89 62.48 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.185 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -68.0 -43.22 82.92 Favored Glycine 0 C--O 1.213 -1.203 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.676 ' O ' HD23 ' A' ' 695' ' ' LEU . 4.5 tt -55.96 -31.45 62.99 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-O 121.071 0.462 . . . . 0.0 110.697 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.416 ' HG2' HD11 ' C' ' 693' ' ' ILE . 2.7 tpp180 -50.34 -35.28 27.09 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.35 -40.49 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 695' ' ' LEU . 10.8 m -55.79 -28.02 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 119.5 -0.88 . . . . 0.0 111.204 -177.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -55.28 -36.82 66.55 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.644 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.1 -48.92 77.44 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 88.4 t -65.65 -39.73 85.82 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . 0.407 ' HA ' HG12 ' A' ' 705' ' ' VAL . 7.2 tt -60.9 -33.1 72.6 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.701 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 21.7 t -64.29 -45.22 88.96 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.208 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 16.5 tp -81.23 -34.09 32.4 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 702' ' ' LEU . 1.8 p -60.87 -18.67 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.697 -178.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -66.26 -12.51 56.76 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 -73.78 -38.58 64.61 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.381 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 2.8 m -95.87 23.53 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.135 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 29.6 ttm180 -96.94 -59.16 1.86 Allowed 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 117.825 -1.084 . . . . 0.0 110.095 179.842 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.505 ' C ' HD12 ' B' ' 661' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.664 HD13 ' CD1' ' A' ' 666' ' ' TRP . 6.7 mp -125.64 92.33 3.58 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.217 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -140.09 160.89 38.93 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.295 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.73 -39.94 68.77 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.688 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -72.63 -32.23 65.75 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.848 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -46.2 64.62 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -72.81 -32.53 65.6 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.383 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.77 -38.12 79.83 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.676 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 26.5 t -59.63 -32.39 70.39 Favored 'General case' 0 C--O 1.218 -0.602 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.817 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 7.9 mt -57.57 -19.41 25.39 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.94 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -68.69 -2.88 10.22 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 119.909 -0.716 . . . . 0.0 112.511 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -81.39 -49.43 10.67 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.918 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.1 p90 -104.23 -23.08 13.29 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.516 177.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 49.7 p90 38.05 25.33 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 178.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -63.63 -53.59 49.02 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.606 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 5.8 tp -69.17 -41.22 81.26 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.394 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.2 m -59.01 -50.57 73.58 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.586 -178.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.52 -33.39 75.81 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 120.061 -0.655 . . . . 0.0 111.029 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.454 ' O ' HG12 ' B' ' 682' ' ' ILE . 15.1 t-105 -72.13 -47.12 53.45 Favored 'General case' 0 C--O 1.209 -1.058 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . 0.676 HD22 HG13 ' B' ' 682' ' ' ILE . 0.2 OUTLIER -86.43 -17.14 35.07 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -176.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 4.2 t90 -69.49 0.72 4.83 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.718 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -126.71 -17.19 5.06 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.676 HG13 HD22 ' B' ' 679' ' ' LEU . 49.3 mm -59.34 -46.21 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 119.113 -0.47 . . . . 0.0 112.049 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 7.4 ptt-85 -56.51 -44.04 80.35 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.222 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 86.4 mt -67.73 -42.92 86.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.604 ' HA ' HD12 ' B' ' 688' ' ' ILE . 0.3 OUTLIER -53.26 -28.18 26.31 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.989 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.701 HG21 HD11 ' C' ' 686' ' ' ILE . 29.9 mm -58.15 -49.7 80.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 C-N-CA 120.864 -0.335 . . . . 0.0 111.132 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 49.9 mt -57.57 -41.73 79.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . 0.604 HD12 ' HA ' ' B' ' 685' ' ' PHE . 61.3 mt -58.1 -42.06 82.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.204 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.485 ' O ' HG12 ' B' ' 689' ' ' VAL . 57.4 t -68.61 -3.04 2.29 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.17 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.013 -179.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.92 -36.83 10.79 Favored Glycine 0 C--N 1.346 1.096 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.54 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 71.0 m -75.09 -27.04 59.73 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 117.077 0.439 . . . . 0.0 111.045 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 mp -53.5 -32.22 49.41 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.982 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 1.6 pp -74.7 -38.17 44.35 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.712 0 C-N-CA 119.886 -0.725 . . . . 0.0 111.155 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.47 -55.24 28.57 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.584 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.709 HD22 ' C ' ' B' ' 695' ' ' LEU . 0.0 OUTLIER -56.56 -28.32 59.9 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 117.298 0.549 . . . . 0.0 111.988 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.518 ' HE ' HD11 ' A' ' 693' ' ' ILE . 0.2 OUTLIER -46.68 -28.49 1.5 Allowed 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 123.022 0.529 . . . . 0.0 112.089 -177.261 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 6.9 tp -57.33 -39.17 66.31 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.217 0 CA-C-O 118.958 -0.544 . . . . 0.0 111.553 -177.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.674 HG22 ' O ' ' B' ' 695' ' ' LEU . 28.7 m -54.88 -28.28 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-N 119.124 0.875 . . . . 0.0 111.548 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -55.21 -25.8 35.34 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -50.5 -50.16 53.63 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.503 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . 0.494 HG22 ' O ' ' B' ' 698' ' ' VAL . 31.0 m -68.03 -32.06 54.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.646 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.1 tt -63.46 -26.97 68.97 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.586 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 40.2 m -63.29 -34.49 77.8 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.285 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 20.0 tp -61.83 -43.19 99.34 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.109 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 81.3 t -65.45 -10.93 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.124 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -76.82 -21.65 54.76 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.633 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.46 -38.97 16.78 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 121.367 -0.133 . . . . 0.0 111.019 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.508 ' O ' HG22 ' B' ' 708' ' ' VAL . 11.4 p -88.15 25.55 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.301 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 46.7 ttt85 -60.07 138.78 57.8 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.503 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.705 -179.866 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 N--CA 1.493 1.721 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.472 HD11 ' CZ2' ' C' ' 666' ' ' TRP . 0.1 OUTLIER -48.88 134.92 16.18 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.951 -179.442 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -168.55 151.84 5.49 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.081 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.696 HD22 ' N ' ' C' ' 664' ' ' ASP . 0.0 OUTLIER -56.67 -29.18 62.06 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.264 -179.166 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . 0.696 ' N ' HD22 ' C' ' 663' ' ' LEU . 4.8 t70 -74.17 -27.19 60.71 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.677 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.89 -39.25 76.37 Favored 'General case' 0 C--O 1.219 -0.535 0 O-C-N 123.355 0.409 . . . . 0.0 110.812 -179.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . 0.472 ' CZ2' HD11 ' C' ' 661' ' ' LEU . 79.8 m95 -63.69 -52.16 61.84 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.4 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -51.89 -34.34 40.84 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 37.4 m -59.12 -34.41 72.01 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.944 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 10.8 mp -78.07 -9.71 59.27 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 11.7 m0 -68.66 -26.24 65.21 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.115 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -62.78 -42.61 99.78 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -79.58 -22.17 44.09 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -177.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 69.08 -44.2 0.53 Allowed 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.895 1.225 . . . . 0.0 113.063 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -57.56 -52.8 63.93 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 118.431 0.56 . . . . 0.0 111.585 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.61 -30.34 46.95 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.531 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.2 m -58.73 -45.24 90.08 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.577 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -78.42 -22.37 47.85 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.932 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -56.37 -22.12 29.15 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.143 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.27 -33.15 13.35 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.903 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . 0.46 ' O ' HD12 ' C' ' 684' ' ' ILE . 0.0 OUTLIER -97.89 24.37 7.0 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.632 -179.266 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -133.03 -39.4 0.95 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.559 HD13 ' C ' ' C' ' 682' ' ' ILE . 0.0 OUTLIER -61.15 -45.62 98.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.51 0 CA-C-N 116.325 -0.398 . . . . 0.0 109.99 178.498 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 30.8 ttp180 -59.29 -46.71 87.82 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 121.237 0.541 . . . . 0.0 110.257 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.46 HD12 ' O ' ' C' ' 680' ' ' TRP . 80.0 mt -67.88 -36.47 75.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.468 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.41 -28.98 14.33 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -175.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.82 HG12 HG23 ' A' ' 686' ' ' ILE . 2.2 mp -60.03 -39.98 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 119.474 -0.891 . . . . 0.0 109.059 178.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 46.5 mt -58.72 -41.51 82.61 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 34.3 mm -59.8 -44.15 93.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.526 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 53.6 t -68.18 -24.15 29.62 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.118 0 CA-C-O 118.924 -0.56 . . . . 0.0 112.149 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.6 -61.23 7.72 Favored Glycine 0 C--N 1.354 1.535 0 N-CA-C 110.149 -1.181 . . . . 0.0 110.149 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 45.4 m -57.33 -31.52 65.78 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.585 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -60.8 -47.17 87.54 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.676 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.693 ' O ' HD13 ' C' ' 693' ' ' ILE . 0.2 OUTLIER -73.09 -34.34 44.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 119.986 -0.685 . . . . 0.0 109.959 179.562 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.82 -43.4 96.59 Favored Glycine 0 CA--C 1.54 1.628 0 C-N-CA 120.665 -0.778 . . . . 0.0 111.335 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.779 HD22 ' O ' ' C' ' 695' ' ' LEU . 0.1 OUTLIER -56.22 -31.29 63.36 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 117.004 0.402 . . . . 0.0 110.572 -179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.406 ' N ' HD13 ' C' ' 695' ' ' LEU . 21.6 mmm180 -49.81 -34.69 20.32 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.727 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.2 OUTLIER -57.89 -40.12 74.73 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -175.225 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.465 HG12 ' O ' ' C' ' 695' ' ' LEU . 8.7 p -54.9 -28.43 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.148 -177.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -60.32 -35.68 76.19 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.05 -39.08 71.48 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.817 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 86.2 t -62.49 -31.86 53.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.115 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 12.7 tp -58.69 -37.03 75.19 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.452 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 10.3 p -57.83 -35.56 71.05 Favored 'General case' 0 C--O 1.219 -0.521 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.844 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.6 tp -58.86 -37.04 75.63 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.811 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 16.3 t -76.28 -16.23 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.201 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -63.12 -28.87 70.36 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . 0.536 ' HG3' HG13 ' C' ' 708' ' ' VAL . 48.2 ptt85 -86.42 -37.36 18.42 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.314 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . 0.536 HG13 ' HG3' ' C' ' 707' ' ' ARG . 33.6 m -90.95 -1.76 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.276 0.472 . . . . 0.0 112.276 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 12.9 mmp_? . . . . . 0 N--CA 1.471 0.606 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.718 179.561 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 660' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.475 HD12 ' CD1' ' C' ' 666' ' ' TRP . 34.0 mt -74.78 177.92 5.85 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -169.75 168.94 8.73 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.417 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.434 HD11 ' N ' ' B' ' 660' ' ' LEU . 8.9 tt -61.59 -40.14 93.72 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.671 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.19 -24.43 62.23 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.738 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -66.54 -46.03 77.48 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.244 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -73.19 -51.96 15.89 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.21 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . 0.478 ' HB2' HD22 ' B' ' 660' ' ' LEU . . . -58.38 -22.63 54.49 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.772 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 13.6 t -60.41 -32.58 71.48 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.298 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 669' ' ' LEU . 3.3 mm? -71.4 -14.22 62.1 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.41 -0.516 . . . . 0.0 112.061 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -68.97 -12.69 61.9 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.95 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -62.65 -48.23 80.22 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.231 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.71 -22.61 15.32 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.094 179.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 9.7 t80 59.02 -0.34 0.14 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -63.53 -53.03 58.26 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 118.894 0.77 . . . . 0.0 110.867 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.52 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -69.05 -31.61 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.826 179.159 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.3 m -58.69 -44.95 90.44 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.76 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -60.64 -41.55 95.16 Favored 'General case' 0 C--O 1.215 -0.721 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.589 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 11.1 t90 -71.17 -27.66 63.69 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.375 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.5 -15.15 31.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -111.13 -5.26 14.78 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -118.42 -11.11 10.03 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.569 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 15.3 tt -66.83 -38.91 82.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.748 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -56.48 -48.33 77.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 120.056 -0.657 . . . . 0.0 109.436 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 82.0 mt -63.7 -46.88 93.45 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -29.09 24.43 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.427 HG23 HG12 ' B' ' 686' ' ' ILE . 1.0 OUTLIER -58.36 -43.34 86.16 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.191 -179.082 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 46.7 mt -58.68 -41.45 82.35 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.259 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 42.5 mm -56.28 -41.31 70.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 689' ' ' VAL . 46.3 t -68.09 -0.27 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 120.531 -0.467 . . . . 0.0 111.411 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -99.24 -31.94 5.99 Favored Glycine 0 CA--C 1.535 1.329 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.1 m -73.72 -16.86 61.18 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.853 0.327 . . . . 0.0 111.232 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.0 -40.14 80.02 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.224 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.703 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.2 OUTLIER -70.61 -35.42 61.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.368 179.668 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.67 -47.78 83.51 Favored Glycine 0 C--N 1.347 1.159 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.632 ' O ' HD23 ' A' ' 695' ' ' LEU . 4.6 tt -56.13 -31.68 63.55 Favored 'General case' 0 C--O 1.21 -1.013 0 CA-C-O 121.032 0.444 . . . . 0.0 110.793 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -50.52 -34.82 26.77 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.5 tp -58.04 -40.07 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -175.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.576 HG22 ' O ' ' A' ' 695' ' ' LEU . 17.4 m -55.27 -28.04 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 118.807 0.73 . . . . 0.0 110.696 -178.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -55.76 -36.38 67.26 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.43 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.66 -50.51 73.58 Favored 'General case' 0 C--O 1.219 -0.536 0 O-C-N 123.291 0.369 . . . . 0.0 111.064 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 698' ' ' VAL . 9.0 p -68.16 -33.99 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 120.491 -0.484 . . . . 0.0 109.939 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . 0.79 ' O ' HG12 ' A' ' 705' ' ' VAL . 0.3 OUTLIER -66.58 -36.99 83.99 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 178.814 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . 0.448 ' N ' HD23 ' A' ' 702' ' ' LEU . 66.8 m -64.4 -43.93 92.9 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.394 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 11.4 tp -81.01 -17.46 50.23 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.79 HG12 ' O ' ' A' ' 702' ' ' LEU . 2.5 p -60.89 -29.24 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.226 -178.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -61.91 -11.12 11.48 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 52.5 ttt85 -73.68 -35.3 65.18 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 121.112 -0.235 . . . . 0.0 110.795 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 47.3 t -102.44 -36.19 4.33 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.531 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.18 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -162.39 154.7 19.14 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.899 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.105 -0.95 . . . . 0.0 110.83 179.972 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 667' ' ' ALA . 12.5 tp . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 55.0 mt -135.93 149.49 48.95 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.358 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -178.6 174.47 1.2 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.61 HD12 ' N ' ' B' ' 664' ' ' ASP . 0.3 OUTLIER -58.3 -15.07 8.86 Favored 'General case' 0 C--O 1.211 -0.967 0 C-N-CA 119.041 -1.063 . . . . 0.0 111.06 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . 0.61 ' N ' HD12 ' B' ' 663' ' ' LEU . 4.0 p-10 -66.25 -39.72 89.68 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -70.67 -46.42 63.22 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.743 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . 0.515 ' CD1' HD12 ' C' ' 661' ' ' LEU . 77.0 m95 -73.19 -30.64 63.69 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -81.52 -10.74 59.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.542 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 5.7 t -75.23 -32.58 61.17 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 121.147 -0.221 . . . . 0.0 110.86 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' B' ' 666' ' ' TRP . 0.0 OUTLIER -65.29 -12.61 53.44 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.686 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 14.1 m95 -68.22 -19.41 64.74 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.112 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -89.46 -47.95 7.65 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . 0.429 ' CH2' HD22 ' B' ' 669' ' ' LEU . 6.1 p-90 -103.16 -23.51 13.64 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 -177.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 51.15 -3.45 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 116.228 1.936 . . . . 0.0 116.228 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -53.27 55.69 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 120.217 1.371 . . . . 0.0 113.68 -177.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.32 -27.93 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 119.639 -0.825 . . . . 0.0 110.755 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.3 m -59.11 -50.06 75.49 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.105 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -69.03 -20.95 64.14 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.542 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 8.2 t90 -72.19 -46.86 54.55 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.43 -10.45 32.42 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -92.55 -15.44 26.97 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 119.886 -0.725 . . . . 0.0 112.226 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -114.04 -31.53 6.33 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.43 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 23.8 mm -65.59 -44.66 93.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-O 119.24 -0.41 . . . . 0.0 111.48 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -42.7 76.63 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.172 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 84.4 mt -68.7 -41.96 82.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.409 ' HA ' HD13 ' B' ' 688' ' ' ILE . 10.9 t80 -52.79 -28.86 24.38 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.024 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.686 HG21 HD12 ' C' ' 686' ' ' ILE . 1.4 mp -58.73 -37.61 67.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.5 mt -58.54 -41.87 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . 0.513 HD12 ' N ' ' B' ' 688' ' ' ILE . 2.7 mp -62.34 -41.28 91.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.451 ' O ' HG12 ' B' ' 689' ' ' VAL . 47.2 t -67.86 -4.14 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.305 -179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.46 -45.11 7.06 Favored Glycine 0 C--N 1.348 1.24 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 2.5 m -69.76 -22.9 63.31 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.856 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -54.34 -32.94 57.9 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.964 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 1.9 pp -65.2 -38.21 82.08 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.808 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . 0.687 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -64.58 -51.73 49.43 Favored Glycine 0 C--O 1.213 -1.172 0 N-CA-C 111.15 -0.78 . . . . 0.0 111.15 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.428 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.4 OUTLIER -56.72 -42.25 78.87 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.366 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -30.27 13.99 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.687 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.6 tp -58.63 -40.54 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -175.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.428 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -55.88 -28.03 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 118.306 0.503 . . . . 0.0 111.773 -178.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -55.29 -26.98 43.71 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.275 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.77 -35.61 63.97 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.145 178.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 64.8 t -59.86 -32.73 50.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.926 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 1.1 pp -61.44 -30.79 70.8 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.296 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.6 t -58.1 -36.19 72.51 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.988 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . 0.492 ' O ' HG12 ' B' ' 708' ' ' VAL . 18.0 tp -63.93 -32.39 73.9 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.235 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 21.4 t -83.08 -33.71 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 120.969 -0.293 . . . . 0.0 110.375 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -65.28 -34.32 78.07 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.579 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.57 -33.54 62.7 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.56 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.51 ' O ' HG22 ' B' ' 708' ' ' VAL . 9.9 p -111.11 26.11 3.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.292 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -49.35 111.21 0.46 Allowed 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.95 -0.3 . . . . 0.0 111.226 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.976 -179.888 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.515 HD12 ' CD1' ' B' ' 666' ' ' TRP . 3.4 mt -73.45 -172.01 1.1 Allowed 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -144.89 106.93 4.3 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.07 -33.12 68.71 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.359 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -60.55 -23.9 64.98 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.658 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . 0.446 ' CE ' HG21 ' C' ' 675' ' ' ILE . 7.7 tmtt? -70.13 -41.68 73.6 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.15 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . 0.79 ' O ' HD12 ' C' ' 669' ' ' LEU . 76.2 m95 -73.05 -33.89 65.95 Favored 'General case' 0 C--O 1.214 -0.803 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.041 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -83.2 -30.75 27.51 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.013 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 3.3 p -56.23 -30.92 63.0 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.6 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . 0.79 HD12 ' O ' ' C' ' 666' ' ' TRP . 0.0 OUTLIER -55.37 -10.97 0.69 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -177.78 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . 0.762 ' N ' HD13 ' C' ' 669' ' ' LEU . 20.6 m95 -68.19 -31.1 70.39 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.451 -0.9 . . . . 0.0 109.915 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -83.29 -50.0 8.83 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 119.642 -0.823 . . . . 0.0 112.791 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . 0.533 ' CZ3' HG22 ' C' ' 675' ' ' ILE . 4.8 p-90 -97.94 -23.53 15.78 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 116.296 1.961 . . . . 0.0 116.296 -178.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 54.89 -7.38 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 121.453 1.933 . . . . 0.0 115.758 177.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -63.47 -53.06 58.04 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.533 HG22 ' CZ3' ' C' ' 672' ' ' TRP . 0.4 OUTLIER -69.08 -40.03 80.23 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 C-N-CA 118.88 -1.128 . . . . 0.0 112.617 -178.199 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . 0.524 ' HB ' HD23 ' C' ' 669' ' ' LEU . 77.2 m -63.61 -33.78 76.37 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.926 -179.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -64.79 -47.09 79.36 Favored 'General case' 0 C--O 1.21 -0.995 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.113 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.487 ' O ' HG23 ' C' ' 682' ' ' ILE . 2.5 t90 -72.31 -45.99 57.61 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.154 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.554 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -71.57 -32.86 68.54 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.735 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -110.37 62.29 0.6 Allowed 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -173.92 -33.99 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.231 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.487 HG23 ' O ' ' C' ' 678' ' ' TRP . 16.3 pt -55.19 -36.89 41.39 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.723 0 CA-C-O 119.324 -0.369 . . . . 0.0 111.88 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 10.9 mtp180 -56.69 -48.32 77.93 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.434 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 81.1 mt -67.56 -44.48 86.39 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.562 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.291 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.484 ' HA ' HD12 ' C' ' 688' ' ' ILE . 4.7 m-85 -53.06 -28.45 24.81 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.907 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.686 HD12 HG21 ' B' ' 686' ' ' ILE . 14.8 mm -58.29 -40.11 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 120.023 -0.671 . . . . 0.0 110.098 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.5 mt -59.78 -42.11 87.76 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.601 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.484 HD12 ' HA ' ' C' ' 685' ' ' PHE . 66.6 mt -65.1 -41.44 91.86 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.129 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.617 ' O ' HD12 ' C' ' 692' ' ' LEU . 96.2 t -67.48 -22.34 28.61 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.171 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.872 -176.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.01 -4.13 90.36 Favored Glycine 0 CA--C 1.55 2.251 0 CA-C-N 119.668 1.122 . . . . 0.0 113.665 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 43.3 m -88.82 -34.7 16.95 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.76 1.28 . . . . 0.0 113.223 -178.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . 0.898 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -64.79 -31.75 73.12 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.073 -178.775 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.898 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.0 OUTLIER -69.03 -29.17 42.23 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 179.268 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.69 -40.85 95.38 Favored Glycine 0 CA--C 1.541 1.707 0 C-N-CA 120.193 -1.003 . . . . 0.0 110.97 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.507 ' O ' HD23 ' C' ' 695' ' ' LEU . 1.3 tt -56.8 -34.08 67.31 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.27 -34.83 24.65 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.699 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.2 OUTLIER -58.27 -40.69 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -175.469 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.404 HG12 ' O ' ' C' ' 695' ' ' LEU . 8.2 p -56.02 -28.93 25.74 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.924 0 CA-C-N 119.187 0.903 . . . . 0.0 111.064 -178.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . 0.439 ' O ' HD23 ' C' ' 702' ' ' LEU . 0.1 OUTLIER -57.6 -35.45 70.45 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.759 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.7 -35.62 66.26 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -177.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.84 -31.47 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.799 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . 0.439 HD23 ' O ' ' C' ' 699' ' ' PHE . 1.4 pp -58.54 -25.52 62.56 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.943 -179.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 74.2 m -57.85 -38.35 75.52 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.332 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . 0.574 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.5 OUTLIER -60.15 -39.14 85.31 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.355 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.8 t -69.91 -18.82 22.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.868 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -60.67 -16.65 41.36 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . 0.539 ' HG3' HG23 ' C' ' 708' ' ' VAL . 13.7 ptm180 -73.87 -37.57 64.7 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.703 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . 0.539 HG23 ' HG3' ' C' ' 707' ' ' ARG . 21.0 t -96.46 9.5 6.17 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.801 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 15.2 tpp85 . . . . . 0 N--CA 1.473 0.691 0 O-C-N 122.267 -0.271 . . . . 0.0 110.874 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.654 ' CG ' HD23 ' C' ' 663' ' ' LEU . 10.1 tt . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.623 HD23 ' CE2' ' A' ' 666' ' ' TRP . 1.5 tp -150.72 -54.72 0.15 Allowed 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.393 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 48.42 177.39 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.529 HD12 ' HB2' ' B' ' 660' ' ' LEU . 8.1 tt -52.33 -38.59 58.99 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 114.254 -1.339 . . . . 0.0 111.588 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -60.97 -41.81 97.09 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -177.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . 0.417 ' HG3' ' HA ' ' A' ' 661' ' ' LEU . 23.7 mmtp -71.11 -44.51 65.5 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 118.869 -1.133 . . . . 0.0 112.497 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . 0.623 ' CE2' HD23 ' A' ' 661' ' ' LEU . 85.5 m95 -59.04 -39.2 81.26 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.955 -179.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.23 -39.65 94.4 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.238 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 32.2 t -58.11 -32.68 68.34 Favored 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.557 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.505 HD22 ' OG1' ' A' ' 676' ' ' THR . 0.4 OUTLIER -69.7 -7.76 42.06 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.43 179.812 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 33.8 m0 -75.28 -6.75 51.44 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -62.57 -48.96 77.17 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.283 -179.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.72 -22.53 13.54 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 19.1 p90 49.67 -3.07 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -63.71 -53.55 49.38 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-N 120.355 1.434 . . . . 0.0 110.165 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 14.6 mm -69.43 -27.84 35.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.469 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . 0.505 ' OG1' HD22 ' A' ' 669' ' ' LEU . 32.9 m -58.92 -48.63 80.79 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -64.92 -34.84 79.37 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.456 ' O ' HG23 ' A' ' 682' ' ' ILE . 28.5 t90 -64.38 -19.91 65.79 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.765 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -84.96 -2.68 58.2 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 120.297 -0.561 . . . . 0.0 112.195 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 53.9 t-105 -145.16 -43.93 0.23 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 120.123 -0.631 . . . . 0.0 112.108 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -66.22 -13.08 59.76 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.456 HG23 ' O ' ' A' ' 678' ' ' TRP . 13.7 pt -55.33 -36.15 39.39 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.721 0 C-N-CA 120.536 -0.465 . . . . 0.0 110.935 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.54 ' NH2' HD22 ' B' ' 679' ' ' LEU . 26.0 ttp180 -54.86 -32.77 61.08 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.894 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 45.2 mm -59.69 -48.28 88.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.066 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -67.82 -28.2 67.37 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.543 HD12 HG21 ' C' ' 686' ' ' ILE . 29.2 mm -58.12 -43.16 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.451 0.569 . . . . 0.0 111.853 -177.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 63.4 mt -58.29 -41.88 82.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.024 -179.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 47.5 mt -62.83 -41.49 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.619 ' O ' HD11 ' A' ' 692' ' ' LEU . 60.5 t -68.21 -3.96 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -177.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -101.5 6.21 55.26 Favored Glycine 0 CA--C 1.543 1.794 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.846 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 14.6 m -88.31 -34.23 17.73 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 117.4 0.6 . . . . 0.0 111.781 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.619 HD11 ' O ' ' A' ' 689' ' ' VAL . 0.2 OUTLIER -54.0 -32.64 54.76 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.488 -178.496 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.718 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.2 OUTLIER -61.75 -37.9 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.529 -179.013 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.82 -36.82 74.91 Favored Glycine 0 C--O 1.212 -1.219 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.76 -36.44 69.79 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.53 ' HG3' HD11 ' C' ' 693' ' ' ILE . 86.6 mmt-85 -52.76 -35.94 57.15 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -178.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . 0.433 HD12 ' N ' ' A' ' 698' ' ' VAL . 2.3 pp -59.15 -41.82 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.688 ' O ' HG12 ' A' ' 701' ' ' VAL . 9.2 p -64.88 -29.57 47.79 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.815 0 C-N-CA 118.889 -1.124 . . . . 0.0 111.272 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -55.8 -35.57 66.46 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 121.129 -0.228 . . . . 0.0 110.897 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.91 -35.6 66.77 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.978 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.688 HG12 ' O ' ' A' ' 698' ' ' VAL . 1.7 p -59.91 -33.11 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.914 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.6 tt -65.86 -29.84 70.35 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.182 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 42.3 p -57.59 -47.42 82.15 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.698 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.52 -39.39 94.31 Favored 'General case' 0 C--O 1.215 -0.719 0 CA-C-N 116.34 -0.391 . . . . 0.0 109.95 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 73.8 t -60.85 -15.38 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -80.23 -12.63 59.61 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -73.82 -27.79 61.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 120.091 -0.644 . . . . 0.0 111.579 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 39.1 t -82.81 -36.08 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.438 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.94 179.14 5.05 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.396 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.848 -179.936 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.529 ' HB2' HD12 ' A' ' 663' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.427 HD12 ' CZ2' ' B' ' 666' ' ' TRP . 4.5 mm? -108.3 119.18 38.75 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.936 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -137.98 162.08 35.02 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.381 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.452 ' C ' HD23 ' B' ' 663' ' ' LEU . 10.6 tt -59.18 -40.17 84.84 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.932 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -73.79 -25.32 60.07 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.913 -179.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -68.82 -46.15 69.36 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.783 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . 0.427 ' CZ2' HD12 ' B' ' 661' ' ' LEU . 95.6 m95 -64.52 -53.58 45.79 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 120.834 -0.347 . . . . 0.0 110.856 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . 0.5 ' HB2' HD13 ' C' ' 660' ' ' LEU . . . -58.48 -23.13 56.99 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.116 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.92 -33.29 70.39 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.877 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 68.9 mt -65.03 -17.52 64.52 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -68.51 -2.9 9.79 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 120.612 -0.435 . . . . 0.0 112.002 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -73.32 -48.61 32.98 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.231 -0.588 . . . . 0.0 112.2 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.88 -23.17 13.4 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.82 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 42.8 t80 58.92 -12.25 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -63.55 -52.56 60.58 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 119.345 0.975 . . . . 0.0 111.636 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.496 HD11 HD23 ' B' ' 679' ' ' LEU . 6.6 tp -68.46 -27.77 37.84 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.971 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.613 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 25.8 m -58.41 -41.77 85.71 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.405 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -45.56 92.15 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.827 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -72.14 -37.3 69.47 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.064 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . 0.54 HD22 ' NH2' ' A' ' 683' ' ' ARG . 0.2 OUTLIER -78.66 -3.09 42.31 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -178.149 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -120.37 -35.2 3.47 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 120.138 -0.625 . . . . 0.0 112.115 -178.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -66.52 -7.69 21.65 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.295 -0.562 . . . . 0.0 112.156 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.546 ' O ' HD13 ' B' ' 686' ' ' ILE . 0.2 OUTLIER -67.8 -46.27 82.72 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 119.926 -0.71 . . . . 0.0 112.535 -179.326 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 37.3 ptt180 -62.96 -42.8 99.93 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 118.58 0.627 . . . . 0.0 111.654 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 94.7 mt -65.7 -43.98 93.5 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -57.27 -34.18 68.39 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.22 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.905 HG21 HD11 ' C' ' 686' ' ' ILE . 1.1 mp -58.72 -46.14 90.73 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 62.7 mt -58.65 -41.6 82.66 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.548 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 15.6 mm -59.64 -42.92 89.99 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.547 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 75.3 t -68.38 -15.74 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 CA-C-O 119.277 -0.392 . . . . 0.0 111.885 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -71.27 -54.18 9.36 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 44.1 m -64.44 -23.22 67.21 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.291 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.99 -32.77 55.09 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.565 -178.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 2.4 pp -65.3 -39.37 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.097 -178.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.18 -48.06 78.71 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.098 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.406 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.1 mt -56.83 -42.25 79.29 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 117.153 0.477 . . . . 0.0 111.9 -178.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.48 -29.92 11.57 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.743 HD11 ' HD3' ' C' ' 696' ' ' ARG . 41.7 mm -58.44 -40.57 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 CA-C-O 119.023 -0.513 . . . . 0.0 111.679 -176.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.406 HG12 ' O ' ' B' ' 695' ' ' LEU . 5.4 p -55.76 -28.16 23.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 118.652 0.66 . . . . 0.0 111.296 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -55.35 -26.84 43.37 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.346 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.66 54.23 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.006 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.99 -34.92 58.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.219 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.33 -35.23 73.44 Favored 'General case' 0 C--O 1.219 -0.522 0 O-C-N 123.007 0.192 . . . . 0.0 110.608 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.6 t -57.98 -31.85 67.31 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.855 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 6.9 tp -60.65 -42.5 97.11 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 61.1 t -73.69 -19.82 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -64.44 -8.63 14.2 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 28.2 mtt180 -73.96 -40.95 62.66 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.175 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 34.9 t -87.52 -36.19 9.34 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.784 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 -122.26 145.32 48.34 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.138 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 . . . . . 0 C--O 1.221 -0.424 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.683 -179.925 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' B' ' 667' ' ' ALA . 58.1 mt . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 2.1 tp -45.77 142.07 2.67 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 111.45 0.167 . . . . 0.0 111.45 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . 0.434 ' HG3' HD12 ' B' ' 663' ' ' LEU . 2.0 mt-10 -169.7 165.69 9.97 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.197 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.691 HD13 ' H ' ' C' ' 664' ' ' ASP . 0.0 OUTLIER -58.09 -31.12 66.8 Favored 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.509 -179.416 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . 0.691 ' H ' HD13 ' C' ' 663' ' ' LEU . 6.2 t70 -74.22 -27.43 60.79 Favored 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -63.28 -42.31 99.08 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.321 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -58.74 -31.41 68.29 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.55 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.89 -16.17 6.25 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.513 178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 17.6 m -53.23 -32.96 50.86 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.45 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' C' ' 673' ' ' PHE . 11.9 tp -55.83 -13.44 1.78 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.841 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -69.59 -43.44 72.79 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -177.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -88.78 -52.01 5.35 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 117.25 -1.78 . . . . 0.0 113.67 -177.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . 0.425 ' CE3' ' HB2' ' C' ' 674' ' ' ASP 0.258 6.0 p-90 -103.96 -21.96 13.55 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 178.142 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . 0.437 ' HA ' HD12 ' C' ' 669' ' ' LEU . 2.2 t80 72.53 -27.77 0.19 Allowed 'General case' 0 C--N 1.373 1.622 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . 0.425 ' HB2' ' CE3' ' C' ' 672' ' ' TRP . 0.1 OUTLIER -64.26 -53.08 54.65 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -175.419 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 10.9 tp -69.76 -48.8 62.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 CA-C-N 120.946 1.703 . . . . 0.0 115.25 -176.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . 0.404 ' HB ' ' CD1' ' C' ' 669' ' ' LEU . 19.8 m -61.27 -33.88 74.26 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 118.973 -1.091 . . . . 0.0 109.123 -178.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -62.84 -17.5 61.46 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.082 177.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.406 ' O ' HD13 ' C' ' 682' ' ' ILE . 19.6 t90 -71.89 -44.66 63.37 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.501 ' N ' HD12 ' C' ' 679' ' ' LEU . 7.5 mp -67.93 -2.77 8.07 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.596 -178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.35 168.85 18.16 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 78.49 -39.05 0.25 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.541 0.736 . . . . 0.0 110.711 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.406 HD13 ' O ' ' C' ' 678' ' ' TRP . 1.7 mp -58.77 -36.8 62.54 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -55.83 -44.47 77.96 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.061 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 44.3 mt -68.33 -36.81 76.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.347 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -52.01 -30.21 24.3 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.905 HD11 HG21 ' B' ' 686' ' ' ILE . 1.8 mp -64.07 -42.98 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 65.6 mt -58.84 -41.22 82.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 46.5 mm -56.8 -41.86 76.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.495 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 57.4 t -67.81 -31.51 52.55 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 119.904 -0.719 . . . . 0.0 111.358 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . 0.448 ' O ' HG22 ' C' ' 693' ' ' ILE . . . -55.09 -47.68 72.18 Favored Glycine 0 C--N 1.353 1.506 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.6 -33.98 76.88 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.169 178.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.2 tp -62.04 -57.06 13.05 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.612 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.771 ' O ' HD13 ' C' ' 693' ' ' ILE . 0.1 OUTLIER -55.96 -29.07 25.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.128 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.24 -41.09 94.7 Favored Glycine 0 CA--C 1.541 1.695 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.667 ' O ' HG22 ' C' ' 698' ' ' VAL . 0.9 OUTLIER -56.54 -31.22 63.95 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 117.369 0.584 . . . . 0.0 111.223 179.396 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.743 ' HD3' HD11 ' B' ' 697' ' ' ILE . 1.5 mmt180 -49.78 -35.24 21.86 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 6.9 tp -58.68 -40.92 80.84 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -175.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.667 HG22 ' O ' ' C' ' 695' ' ' LEU . 16.4 m -55.91 -28.5 24.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 CA-C-N 119.305 0.957 . . . . 0.0 111.31 -178.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -55.63 -35.5 65.98 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.299 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.81 -39.02 70.76 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.015 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 75.2 t -68.05 -39.79 82.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.92 -28.8 66.57 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.512 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 23.4 p -59.92 -35.52 75.06 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.652 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.2 tp -59.11 -40.62 85.91 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 20.1 t -66.29 -19.8 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.594 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -60.76 -10.91 6.12 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 23.0 ptt85 -101.02 -12.76 18.62 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 55.9 t -82.86 -30.86 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.226 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 83.4 mtm-85 . . . . . 0 C--O 1.218 -0.572 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.27 -179.083 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.46 HD22 ' CD1' ' C' ' 666' ' ' TRP . 5.4 tp -67.11 -146.74 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -169.34 96.34 0.33 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.367 0.53 . . . . 0.0 110.919 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.515 ' C ' HD23 ' A' ' 663' ' ' LEU . 9.9 tt -67.08 -40.43 87.01 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-O 120.929 0.395 . . . . 0.0 111.368 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -68.21 -23.5 64.83 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.248 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -67.26 -34.6 77.77 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.709 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -61.08 -35.74 77.79 Favored 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.512 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . 0.401 ' HB2' HD22 ' B' ' 660' ' ' LEU . . . -92.37 -19.26 22.28 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.97 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 75.5 m -73.91 -37.34 64.68 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.044 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.531 ' C ' HD12 ' A' ' 669' ' ' LEU . 4.4 pp -63.48 -9.06 11.05 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.889 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -68.34 -19.73 64.67 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.219 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -84.67 -48.13 9.78 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 4.5 p90 -100.95 -22.74 14.7 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 118.082 0.401 . . . . 0.0 111.967 -178.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 48.58 16.64 0.11 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -63.4 -54.03 43.13 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.18 -177.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.626 HD12 HD12 ' A' ' 679' ' ' LEU . 0.3 OUTLIER -69.77 -31.32 47.96 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 C-N-CA 119.699 -0.8 . . . . 0.0 110.704 178.291 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 13.8 m -58.26 -33.84 69.84 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.459 -178.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -59.69 -44.05 93.8 Favored 'General case' 0 C--O 1.215 -0.753 0 C-N-CA 119.817 -0.753 . . . . 0.0 108.973 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -72.82 -46.09 54.94 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.451 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.626 HD12 HD12 ' A' ' 675' ' ' ILE . 14.1 mt -67.57 -2.87 7.34 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -177.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.7 m95 -133.23 142.51 48.6 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 92.12 -32.51 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.232 1.013 . . . . 0.0 111.277 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.613 HD12 ' N ' ' A' ' 683' ' ' ARG . 2.7 pp -68.09 -41.23 84.13 Favored 'Isoleucine or valine' 0 C--N 1.35 0.624 0 C-N-CA 119.315 -0.954 . . . . 0.0 109.55 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.613 ' N ' HD12 ' A' ' 682' ' ' ILE . 54.3 ttp180 -69.28 -47.08 65.62 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.98 -37.43 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.734 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -52.19 -43.72 64.34 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.865 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.484 HG12 HG22 ' C' ' 686' ' ' ILE . 1.9 mp -58.73 -37.91 68.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.753 179.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 39.6 mm -58.04 -42.13 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 80.2 mt -59.86 -41.19 84.94 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 176.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.664 HG13 HG21 ' C' ' 693' ' ' ILE . 57.2 t -67.51 -25.41 33.15 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.593 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.76 -32.28 81.12 Favored Glycine 0 C--N 1.35 1.336 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.9 m -86.16 -31.82 21.59 Favored 'General case' 0 C--O 1.219 -0.529 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.418 HD23 HD12 ' C' ' 693' ' ' ILE . 5.2 tp -59.69 -44.63 93.58 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.009 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.555 HD11 ' CG ' ' B' ' 696' ' ' ARG . 4.1 tp -55.58 -35.85 39.88 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.988 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -72.61 -40.11 54.44 Favored Glycine 0 C--O 1.215 -1.078 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.799 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.8 OUTLIER -56.8 -40.21 75.51 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 120.861 0.362 . . . . 0.0 110.886 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.747 ' HG3' HD11 ' C' ' 693' ' ' ILE . 40.4 mmt180 -53.31 -35.21 59.91 Favored 'General case' 0 C--O 1.214 -0.789 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . 0.672 HD13 ' O ' ' A' ' 697' ' ' ILE . 0.2 OUTLIER -58.27 -40.69 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 120.451 -0.499 . . . . 0.0 112.008 -176.019 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.799 HG12 ' O ' ' A' ' 695' ' ' LEU . 12.4 p -55.96 -28.26 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.021 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -55.41 -35.88 65.85 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.602 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.02 -35.71 67.15 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.435 -0.506 . . . . 0.0 109.763 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 92.6 t -65.77 -34.36 69.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 9.0 tp -60.28 -29.84 69.08 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.915 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 26.8 m -57.95 -45.52 86.51 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.657 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 15.0 tp -64.88 -39.99 94.42 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 78.0 t -69.73 -24.94 27.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.56 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -71.0 -31.38 67.89 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.402 ' HG3' HG13 ' A' ' 708' ' ' VAL . 0.1 OUTLIER -74.38 -23.11 58.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.843 -179.172 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.402 HG13 ' HG3' ' A' ' 707' ' ' ARG . 33.9 m -99.36 25.97 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 C-N-CA 120.534 -0.467 . . . . 0.0 111.259 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -51.09 70.85 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.357 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.83 179.741 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.401 HD22 ' HB2' ' A' ' 667' ' ' ALA . 9.8 tp . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 60.3 mt 61.13 123.61 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.344 0.403 . . . . 0.0 111.091 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -158.32 176.94 11.82 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.99 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.74 -39.52 88.99 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.486 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.09 -28.23 64.18 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.693 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -69.95 -46.02 66.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.741 -179.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -70.14 -37.58 75.29 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.591 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.32 -41.96 80.07 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.0 p -54.48 -31.5 55.93 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.475 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.851 HD21 HG23 ' B' ' 675' ' ' ILE . 13.0 tp -61.84 -10.5 9.33 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.918 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . 0.416 ' HZ2' HD13 ' C' ' 660' ' ' LEU . 37.8 m0 -68.4 -25.51 65.08 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.885 -0.726 . . . . 0.0 111.112 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -62.98 -46.29 88.41 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -23.91 13.6 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 120.009 -0.676 . . . . 0.0 111.447 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 72.7 t80 45.56 10.47 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -64.13 -54.7 29.66 Favored 'General case' 0 C--N 1.354 0.782 0 CA-C-N 119.74 1.155 . . . . 0.0 113.356 -177.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.851 HG23 HD21 ' B' ' 669' ' ' LEU . 9.2 tp -69.98 -27.58 33.27 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.914 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.838 178.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 9.4 m -58.71 -45.9 88.52 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.898 -178.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -61.81 -47.19 86.24 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.264 -0.575 . . . . 0.0 111.557 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.403 ' CE3' HD12 ' B' ' 675' ' ' ILE . 3.6 t90 -72.21 -42.04 66.21 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 7.9 tp -74.25 -33.01 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -177.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -96.28 23.95 6.19 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.204 -0.599 . . . . 0.0 112.326 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -137.9 11.47 2.88 Favored 'General case' 0 C--O 1.218 -0.583 0 C-N-CA 120.396 -0.521 . . . . 0.0 111.549 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.433 HD13 ' HD2' ' A' ' 683' ' ' ARG . 16.8 pt -65.05 -43.3 95.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 87.9 mtm-85 -59.69 -46.18 89.85 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.105 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.487 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -68.33 -39.22 80.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.132 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -62.27 -51.16 68.82 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.521 HG21 HD12 ' C' ' 686' ' ' ILE . 2.6 mp -65.14 -39.82 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.491 -178.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 80.4 mt -58.75 -41.71 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.855 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 55.3 mt -58.54 -41.63 82.41 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 61.2 t -67.79 -29.4 44.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.878 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.92 -43.33 96.82 Favored Glycine 0 C--N 1.35 1.351 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -34.09 73.81 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 3.7 tp -63.53 -43.38 97.3 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.944 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.49 HG12 HD13 ' A' ' 693' ' ' ILE . 0.4 OUTLIER -66.13 -39.1 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.822 -179.138 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.81 -42.09 87.28 Favored Glycine 0 CA--C 1.531 1.045 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.15 -31.44 63.35 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 120.743 0.306 . . . . 0.0 110.31 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.555 ' CG ' HD11 ' A' ' 693' ' ' ILE . 2.0 tpm_? -50.71 -31.9 17.88 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 122.814 0.446 . . . . 0.0 111.896 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 45.5 mt -60.17 -42.87 91.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.356 -177.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.524 ' O ' HG22 ' B' ' 701' ' ' VAL . 44.2 t -57.0 -28.94 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.517 -178.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -25.41 39.91 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.72 -35.52 22.29 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . 0.524 HG22 ' O ' ' B' ' 698' ' ' VAL . 33.8 m -59.82 -32.03 48.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 120.07 -0.652 . . . . 0.0 110.668 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 20.0 tp -60.26 -38.3 83.09 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.799 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 6.4 t -57.93 -38.87 76.7 Favored 'General case' 0 C--O 1.22 -0.479 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.975 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.9 tp -65.78 -42.8 90.36 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.072 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 39.8 t -71.25 -23.72 23.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.601 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.69 -14.82 62.03 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.16 -30.97 17.28 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.531 -179.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 34.8 m -88.39 -25.61 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.492 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -96.79 140.04 31.95 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.742 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.758 179.944 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.416 HD13 ' HZ2' ' B' ' 670' ' ' TRP . 23.1 tp . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 tp -143.49 113.39 7.15 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -146.09 163.76 34.28 Favored 'General case' 0 C--O 1.218 -0.582 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.744 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.425 HD23 ' HB3' ' A' ' 661' ' ' LEU . 10.5 mt -61.42 -38.78 88.35 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.851 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.87 -28.62 62.61 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.534 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -70.23 -44.13 69.21 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.154 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . 0.46 ' CD1' HD22 ' A' ' 661' ' ' LEU . 78.6 m95 -60.56 -57.05 14.37 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.368 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.57 -47.02 77.09 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.146 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 78.6 p -60.2 -31.94 70.63 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 123.224 0.328 . . . . 0.0 111.179 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 11.9 tp -64.19 -4.64 3.82 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -68.27 -6.59 24.65 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.818 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -63.17 -37.06 85.73 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -79.84 -22.68 42.69 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -176.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 64.23 -71.42 0.07 Allowed 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.198 1.363 . . . . 0.0 112.462 178.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -50.84 -49.69 58.32 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 46.1 mm -65.96 -40.53 87.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.666 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.2 m -58.93 -49.82 76.38 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.146 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -67.74 -40.53 84.15 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.516 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -60.53 -36.84 79.38 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.531 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 5.9 tp -76.9 -14.25 59.9 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 3.3 t90 -111.16 -19.12 12.82 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -95.0 -38.25 10.75 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.626 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 47.5 mm -57.57 -36.9 55.67 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.512 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.659 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.7 -33.91 66.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.06 178.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -68.0 -41.58 84.67 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -56.25 -28.05 57.17 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.883 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.521 HD12 HG21 ' B' ' 686' ' ' ILE . 36.8 mm -58.2 -45.44 88.84 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.577 -177.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 41.1 mt -65.42 -40.79 89.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 21.2 mm -55.95 -41.13 66.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.496 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.734 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 61.3 t -67.12 -23.66 30.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 120.033 -0.667 . . . . 0.0 111.942 -178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . 0.59 ' O ' HG22 ' C' ' 693' ' ' ILE . . . -59.63 -51.35 59.55 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-N 119.189 0.904 . . . . 0.0 111.555 179.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 2.0 m -72.72 -21.89 60.97 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 117.247 0.523 . . . . 0.0 112.181 -179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.7 tp -55.95 -38.27 70.11 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.888 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.747 HD11 ' HG3' ' A' ' 696' ' ' ARG . 0.0 OUTLIER -73.77 -23.03 18.89 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.579 -179.801 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.48 -47.43 89.91 Favored Glycine 0 CA--C 1.542 1.76 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.102 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.506 ' O ' HD23 ' C' ' 695' ' ' LEU . 1.0 OUTLIER -56.54 -30.69 63.37 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.257 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -49.65 -34.92 19.69 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -177.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.593 HD13 ' NH2' ' A' ' 696' ' ' ARG . 7.2 tp -58.17 -40.27 76.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -175.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.456 HG12 ' O ' ' C' ' 695' ' ' LEU . 9.6 p -55.72 -28.55 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 CA-C-N 118.968 0.804 . . . . 0.0 111.449 -178.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -55.65 -35.32 65.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.37 -35.97 65.85 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.318 -177.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 77.5 t -64.73 -31.66 54.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 120.181 -0.608 . . . . 0.0 109.77 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.9 tp -58.83 -40.76 85.13 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.77 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 95.1 p -62.32 -33.92 75.61 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.141 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 19.5 tp -60.39 -42.9 96.86 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.13 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 27.2 m -83.2 -11.53 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.735 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -67.38 -21.05 65.63 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.45 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -73.53 -39.64 64.62 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.498 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 46.4 t -89.4 -35.94 8.16 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.236 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 . . . . . 0 C--O 1.219 -0.518 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.308 -179.944 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.444 ' O ' ' O ' ' A' ' 661' ' ' LEU . 3.0 mp . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.467 ' O ' HD12 ' C' ' 663' ' ' LEU . 3.9 pp 39.75 -176.16 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 172.73 -179.07 0.07 Allowed 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.128 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.689 HD13 ' N ' ' A' ' 664' ' ' ASP . 0.0 OUTLIER -58.88 -40.59 84.84 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-O 120.791 0.329 . . . . 0.0 110.244 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . 0.689 ' N ' HD13 ' A' ' 663' ' ' LEU . 37.0 t70 -73.94 -23.97 59.59 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.851 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -67.06 -45.45 77.33 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.293 -179.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -64.47 -38.61 91.64 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.978 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . 0.675 ' HB2' ' CD1' ' B' ' 660' ' ' LEU . . . -72.8 -47.18 48.66 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.508 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 89.9 p -59.58 -31.64 69.63 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.038 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.611 HD11 HG22 ' A' ' 675' ' ' ILE . 56.6 tp -56.47 -26.78 55.15 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.062 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -68.54 -9.95 52.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 119.512 -0.875 . . . . 0.0 111.997 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -62.76 -48.85 77.37 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.583 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.68 -22.57 13.55 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.347 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 48.2 p90 41.39 22.05 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -63.89 -52.8 58.28 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.782 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.611 HG22 HD11 ' A' ' 669' ' ' LEU . 0.3 OUTLIER -68.67 -33.22 58.49 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.748 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.581 -179.202 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 51.7 p -58.44 -37.78 76.13 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.619 -178.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -60.57 -41.64 95.03 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.344 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 7.0 t90 -72.81 -46.42 53.22 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 679' ' ' LEU . 0.6 OUTLIER -91.54 -33.46 15.15 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.593 0.961 . . . . 0.0 113.593 -176.138 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.15 -11.02 60.38 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.287 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -110.16 -30.1 7.89 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 121.093 -0.243 . . . . 0.0 110.603 179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.442 ' O ' HD13 ' A' ' 686' ' ' ILE . 1.2 mm -60.0 -43.83 93.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 45.9 ttp180 -62.2 -48.45 79.95 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.244 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 80.0 mt -64.12 -44.06 97.55 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.454 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -52.65 -27.83 18.93 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.771 HG21 HD11 ' B' ' 686' ' ' ILE . 1.2 mp -57.54 -48.38 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.218 -177.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 49.1 mt -58.59 -41.92 83.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.321 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 69.1 mt -60.19 -45.18 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.9 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 13.4 m -68.81 2.0 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 119.811 -0.755 . . . . 0.0 112.27 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -85.6 -64.2 1.51 Allowed Glycine 0 C--N 1.347 1.173 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 29.8 m -52.1 -25.16 8.12 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.611 -0.435 . . . . 0.0 110.683 178.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.636 HD23 HD11 ' C' ' 693' ' ' ILE . 2.3 tp -54.03 -32.58 54.79 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.785 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -35.39 73.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.156 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.919 -178.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.02 -56.28 5.87 Favored Glycine 0 CA--C 1.537 1.43 0 C-N-CA 120.007 -1.092 . . . . 0.0 113.767 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.753 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.0 OUTLIER -60.36 -31.6 70.48 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.992 1.396 . . . . 0.0 110.456 179.905 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.529 ' H ' HD13 ' A' ' 695' ' ' LEU . 20.1 tpp180 -50.74 -35.88 33.68 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-O 120.723 0.297 . . . . 0.0 110.348 177.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 58.1 mt -59.21 -40.35 80.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.782 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.753 HG12 ' O ' ' A' ' 695' ' ' LEU . 3.5 p -55.55 -28.06 22.27 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.807 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.347 -178.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -55.04 -35.4 64.42 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.929 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.78 -35.59 66.43 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.911 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.664 HG12 ' O ' ' A' ' 698' ' ' VAL . 1.7 p -59.88 -34.2 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.075 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.05 -24.84 67.86 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.284 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 32.1 m -57.87 -44.75 86.83 Favored 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.778 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.54 -40.39 92.84 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 61.6 t -60.61 -28.33 42.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.342 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -63.33 -7.33 6.13 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 11.2 ttp85 -73.6 -44.82 56.18 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.485 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 43.0 t -89.42 -36.03 8.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.219 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 38.23 46.99 0.94 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 58.3 tp60 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.017 -0.992 . . . . 0.0 111.037 179.753 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.675 ' CD1' ' HB2' ' A' ' 667' ' ' ALA . 55.8 mt . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.642 ' H ' HD23 ' A' ' 663' ' ' LEU . 0.2 OUTLIER -146.84 135.36 21.97 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.287 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -168.75 137.99 2.23 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.579 HD22 ' C ' ' B' ' 663' ' ' LEU . 0.0 OUTLIER -55.01 -18.25 4.89 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.356 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -72.48 -31.46 65.4 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 121.058 -0.257 . . . . 0.0 110.753 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -69.43 -44.91 70.36 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.369 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 85.4 m95 -66.23 -38.84 88.88 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.355 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.4 -35.83 71.17 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.144 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 2.9 t -54.98 -31.44 60.86 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.075 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.421 HD22 ' CH2' ' B' ' 672' ' ' TRP . 8.7 mt -62.9 -14.8 50.95 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.934 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -68.79 -28.27 66.62 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.962 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -62.83 -47.93 81.26 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.508 -0.477 . . . . 0.0 112.197 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . 0.59 ' CZ3' HG22 ' B' ' 675' ' ' ILE . 0.0 OUTLIER -103.44 -22.46 13.65 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.717 -178.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 53.45 7.83 0.11 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -63.45 -53.22 55.63 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.291 0.95 . . . . 0.0 112.276 -178.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.59 HG22 ' CZ3' ' B' ' 672' ' ' TRP . 8.8 tp -68.97 -32.8 55.98 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.75 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.632 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -59.02 -46.77 87.36 Favored 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.441 -178.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -64.68 -46.67 81.45 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.823 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.556 ' CE3' HD12 ' B' ' 675' ' ' ILE . 5.4 t90 -65.18 -38.19 89.74 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.088 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . 0.401 HD13 ' O ' ' B' ' 679' ' ' LEU . 0.1 OUTLIER -87.42 -19.34 28.2 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -100.61 9.68 42.17 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.619 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -129.99 -1.24 4.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.525 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.412 ' O ' HD12 ' B' ' 686' ' ' ILE . 12.7 tt -68.46 -44.18 83.4 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 17.1 ttm105 -55.81 -47.89 76.37 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.498 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . 0.5 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.2 mp -64.54 -36.92 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.773 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.448 ' O ' HG23 ' B' ' 689' ' ' VAL . 46.1 t80 -52.01 -39.09 58.94 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 119.101 -0.476 . . . . 0.0 112.26 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.771 HD11 HG21 ' A' ' 686' ' ' ILE . 3.2 mp -60.27 -38.55 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 119.79 -0.764 . . . . 0.0 109.956 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.77 -41.91 83.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . 0.568 ' H ' HD12 ' B' ' 688' ' ' ILE . 3.8 mp -66.69 -42.19 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.461 ' O ' HG12 ' B' ' 689' ' ' VAL . 66.1 t -68.52 -1.78 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.202 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.151 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -91.75 -45.57 3.92 Favored Glycine 0 C--N 1.35 1.343 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 27.3 m -53.52 -30.13 39.96 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.121 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 8.4 mp -61.71 -36.3 80.52 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.034 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.747 HG21 HD23 ' C' ' 692' ' ' LEU . 0.3 OUTLIER -59.27 -33.37 50.66 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 120.164 -0.614 . . . . 0.0 110.756 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -70.03 -36.46 72.63 Favored Glycine 0 CA--C 1.534 1.241 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 179.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.54 ' O ' HG22 ' B' ' 698' ' ' VAL . 1.0 OUTLIER -56.14 -31.6 63.49 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.426 -178.85 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.16 -31.56 13.89 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.602 HD11 ' NH2' ' C' ' 696' ' ' ARG . 48.7 mm -59.91 -48.29 88.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.427 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.54 HG22 ' O ' ' B' ' 695' ' ' LEU . 16.1 m -66.75 -28.36 42.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.752 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -55.49 -26.82 44.77 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.623 -179.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.6 -40.68 79.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.459 -0.496 . . . . 0.0 109.875 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 63.0 t -64.49 -42.62 95.76 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.11 -38.64 89.66 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.472 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 68.1 m -57.91 -34.54 69.95 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.963 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.8 tp -66.1 -42.1 89.7 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.995 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.69 -17.43 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.915 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -60.96 -26.2 67.37 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.465 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -73.79 -36.45 65.04 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.851 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 43.0 t -82.91 -36.13 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.273 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 66.3 mtm180 -144.01 130.92 20.39 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.709 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 C--O 1.22 -0.479 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.648 -179.97 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 3.1 tt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 28.3 mt -136.27 132.04 35.22 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -170.6 -176.51 2.12 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.099 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.467 HD12 ' O ' ' A' ' 661' ' ' LEU . 8.1 tt -52.45 -31.39 34.47 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.371 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -71.21 -40.35 71.2 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.707 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.7 mmtt -70.22 -43.51 70.5 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.169 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -60.24 -44.67 95.03 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.96 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.63 -41.04 88.93 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.534 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 20.1 m -56.58 -31.94 64.73 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.269 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 9.2 tp -70.48 -4.72 24.15 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -72.71 -13.77 61.41 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -178.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -62.77 -50.42 71.12 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 118.291 -1.364 . . . . 0.0 110.593 -178.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . 0.415 ' O ' ' N ' ' C' ' 674' ' ' ASP . 0.3 OUTLIER -101.75 -23.35 14.22 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 178.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 49.0 p90 42.01 9.19 0.0 OUTLIER 'General case' 0 C--N 1.362 1.128 0 N-CA-C 116.408 2.003 . . . . 0.0 116.408 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' C' ' 672' ' ' TRP . 30.2 t70 -64.22 -53.97 40.9 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 120.156 1.344 . . . . 0.0 110.662 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 9.3 tp -69.88 -29.67 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.454 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 17.3 m -58.45 -40.02 81.5 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.504 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.43 -46.31 90.5 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 119.964 -0.694 . . . . 0.0 109.564 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.482 ' O ' HG22 ' C' ' 682' ' ' ILE . 28.3 t90 -56.84 -39.09 73.6 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.259 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.01 -2.87 42.31 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -179.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 4.7 t90 -146.83 44.06 1.17 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 119.772 -0.771 . . . . 0.0 112.325 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -161.18 -42.32 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.725 HD13 ' O ' ' C' ' 682' ' ' ILE . 0.1 OUTLIER -55.88 -36.91 45.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.49 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 3.5 ptt-85 -55.81 -40.73 73.16 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 40.5 mm -59.85 -41.3 85.3 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.49 ' HA ' HD13 ' C' ' 688' ' ' ILE . 1.3 t80 -67.09 -27.77 67.63 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.807 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.685 ' CG2' HD11 ' A' ' 686' ' ' ILE . 1.1 tp -57.89 -43.6 84.83 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.727 -177.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 39.2 mt -59.27 -41.64 84.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.027 -179.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.591 ' H ' HD12 ' C' ' 688' ' ' ILE . 3.4 mp -56.82 -41.5 75.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 52.4 t -67.67 -31.38 52.2 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.126 0 CA-C-O 118.684 -0.674 . . . . 0.0 112.197 -177.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -62.74 -53.48 40.83 Favored Glycine 0 CA--C 1.538 1.491 0 CA-C-N 119.415 1.007 . . . . 0.0 111.632 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.5 m -61.83 -24.39 66.86 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 117.231 0.515 . . . . 0.0 112.377 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . 0.747 HD23 HG21 ' B' ' 693' ' ' ILE . 2.5 tp -54.22 -32.63 56.36 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.711 -178.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.636 HD11 HD23 ' A' ' 692' ' ' LEU . 2.3 pp -70.19 -28.07 34.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 120.259 -0.576 . . . . 0.0 111.134 -178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.71 -55.27 23.57 Favored Glycine 0 CA--C 1.542 1.778 0 C-N-CA 121.182 -0.532 . . . . 0.0 113.125 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.3 tt -58.42 -36.45 73.63 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.602 ' NH2' HD11 ' B' ' 697' ' ' ILE . 0.3 OUTLIER -50.56 -35.85 31.78 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -178.725 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.62 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.2 OUTLIER -59.18 -41.02 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.18 -178.177 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.772 ' O ' HG12 ' C' ' 701' ' ' VAL . 64.9 t -56.49 -29.0 27.91 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.827 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -56.05 -35.25 66.7 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.35 -34.93 64.69 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.103 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . 0.772 HG12 ' O ' ' C' ' 698' ' ' VAL . 9.3 p -59.06 -31.53 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.5 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.59 -30.54 67.27 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.391 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.3 t -57.93 -39.0 76.95 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.849 -0.341 . . . . 0.0 110.428 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 16.3 tp -56.51 -31.21 63.87 Favored 'General case' 0 C--O 1.218 -0.588 0 C-N-CA 120.635 -0.426 . . . . 0.0 109.871 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.8 t -75.66 -17.57 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.042 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -60.66 -22.36 63.77 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.18 -3.7 58.9 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 120.625 -0.43 . . . . 0.0 112.018 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 48.3 t -104.41 -36.03 3.77 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.534 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.319 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 . . . . . 0 C--O 1.217 -0.652 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.959 -179.871 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.513 HD23 ' N ' ' A' ' 660' ' ' LEU . 1.4 pt? . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 9.5 mp -99.72 155.38 17.66 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.252 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -163.51 159.78 22.42 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.758 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 8.9 tt -61.83 -40.53 95.61 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.775 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -72.68 -23.91 60.94 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.478 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -64.41 -40.0 94.93 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.914 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -70.25 -49.61 48.14 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.148 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.81 -31.38 72.32 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.48 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 1.8 m -57.43 -31.59 66.05 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.112 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 70.4 mt -71.27 -4.83 27.97 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -68.98 -1.0 6.37 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -62.32 -49.17 76.69 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 118.41 -1.316 . . . . 0.0 111.887 -176.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -104.23 -11.04 17.46 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.832 177.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.3 p90 43.33 18.84 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -64.42 -52.93 55.61 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.507 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.547 HD11 ' CE3' ' A' ' 678' ' ' TRP . 7.1 tp -68.84 -28.35 39.41 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.316 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 75.7 p -58.9 -40.35 84.2 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 119.818 -0.753 . . . . 0.0 109.386 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -65.33 -33.83 76.9 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.807 178.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.638 ' CD1' HG21 ' A' ' 682' ' ' ILE . 42.3 t90 -69.83 -44.56 69.72 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.868 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.68 -2.6 7.17 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.222 -178.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -136.48 -58.43 0.74 Allowed 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 119.723 -0.791 . . . . 0.0 112.874 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -72.52 -41.44 65.88 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 120.482 -0.487 . . . . 0.0 112.258 -177.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.638 HG21 ' CD1' ' A' ' 678' ' ' TRP . 28.9 mm -67.26 -36.44 76.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -55.29 -48.03 74.68 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.185 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.91 -43.14 91.52 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 C-N-CA 120.991 -0.283 . . . . 0.0 111.178 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.425 ' HA ' HD13 ' A' ' 688' ' ' ILE . 3.2 t80 -52.57 -28.71 22.1 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -177.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.53 HG12 HG21 ' C' ' 686' ' ' ILE . 1.4 mp -57.95 -37.83 63.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 CA-C-O 119.188 -0.434 . . . . 0.0 111.18 -179.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.11 -41.95 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.077 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . 0.581 ' H ' HD12 ' A' ' 688' ' ' ILE . 5.1 mp -64.56 -40.97 90.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.765 ' O ' HD11 ' A' ' 692' ' ' LEU . 21.9 t -68.32 4.38 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -178.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -110.71 -5.77 27.29 Favored Glycine 0 CA--C 1.543 1.828 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 178.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 54.2 m -88.24 -32.84 18.33 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 117.141 0.471 . . . . 0.0 111.343 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.765 HD11 ' O ' ' A' ' 689' ' ' VAL . 0.2 OUTLIER -53.67 -32.6 52.29 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.089 -178.237 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.734 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.1 OUTLIER -54.82 -34.18 29.98 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 120.3 -0.56 . . . . 0.0 109.898 179.692 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.42 -43.82 36.22 Favored Glycine 0 C--N 1.346 1.117 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 177.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.437 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.4 OUTLIER -56.43 -37.43 70.2 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.151 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -50.68 -35.37 30.58 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 122.776 0.431 . . . . 0.0 111.152 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 75.2 mt -59.31 -41.97 85.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 CA-C-O 118.994 -0.527 . . . . 0.0 111.214 -176.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.437 HG12 ' O ' ' A' ' 695' ' ' LEU . 2.4 p -67.6 -28.49 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 118.956 0.798 . . . . 0.0 111.074 179.285 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -55.06 -35.01 64.06 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.461 0.172 . . . . 0.0 110.642 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.42 -35.49 65.44 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.895 -178.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 698' ' ' VAL . 0.5 OUTLIER -60.59 -38.23 77.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.758 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . 0.427 ' O ' HG22 ' A' ' 705' ' ' VAL . 0.0 OUTLIER -61.62 -29.07 69.81 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.755 -179.847 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 4.0 t -63.62 -31.91 73.22 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.101 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 30.6 tp -62.73 -39.52 94.35 Favored 'General case' 0 C--O 1.218 -0.588 0 O-C-N 123.102 0.251 . . . . 0.0 111.085 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 702' ' ' LEU . 35.1 m -82.65 -10.8 12.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -63.81 -24.06 67.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 120.725 -0.39 . . . . 0.0 112.027 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 12.6 ptt-85 -76.6 -19.13 58.18 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 120.378 -0.529 . . . . 0.0 112.305 -179.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 6.7 m -104.99 26.05 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 55.2 mtm180 -86.53 152.95 22.2 Favored 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.572 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.068 -0.967 . . . . 0.0 110.917 -179.908 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.411 ' O ' HD12 ' B' ' 660' ' ' LEU . 3.6 pp . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.513 HD22 ' CZ2' ' B' ' 666' ' ' TRP . 70.2 mt -124.65 154.61 40.48 Favored 'General case' 0 C--O 1.22 -0.479 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.101 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -147.83 145.87 28.89 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.783 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.43 HD23 ' O ' ' B' ' 663' ' ' LEU . 4.6 tt -54.95 -40.01 69.52 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 121.016 0.436 . . . . 0.0 110.325 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.57 -35.46 77.43 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.701 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -68.14 -43.04 79.21 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.45 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . 0.513 ' CZ2' HD22 ' B' ' 661' ' ' LEU . 83.3 m95 -59.75 -48.71 80.59 Favored 'General case' 0 C--O 1.22 -0.449 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.374 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -54.23 -33.03 57.47 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.757 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.51 -32.97 69.32 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.098 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.789 HD11 HG23 ' B' ' 675' ' ' ILE . 49.0 tp -59.53 -17.34 31.43 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.712 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -68.64 -17.07 64.03 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -89.46 -16.65 30.34 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -86.49 -22.66 26.3 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.32 -177.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 41.0 t80 59.87 -73.06 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -51.44 -53.01 41.37 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -176.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.789 HG23 HD11 ' B' ' 669' ' ' LEU . 5.0 tp -68.27 -27.93 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 119.829 -0.749 . . . . 0.0 110.777 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.3 m -63.25 -48.28 78.88 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.589 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -71.24 -41.36 70.23 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.785 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.571 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.5 t90 -62.81 -44.22 96.74 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.331 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . 0.453 HD13 HD11 ' B' ' 675' ' ' ILE . 0.5 OUTLIER -75.78 -27.51 58.04 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.557 -178.126 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.6 t90 -91.89 0.02 57.49 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -119.0 -6.28 10.5 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.626 -0.43 . . . . 0.0 112.092 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.571 HG23 ' O ' ' B' ' 678' ' ' TRP . 7.8 pt -63.44 -42.65 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.669 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -43.95 77.01 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.769 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 56.8 mt -66.65 -37.74 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 178.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -55.8 -29.97 60.59 Favored 'General case' 0 C--O 1.218 -0.601 0 C-N-CA 121.112 -0.235 . . . . 0.0 111.47 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.599 HG21 HG13 ' C' ' 686' ' ' ILE . 27.2 mm -60.02 -41.84 87.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.45 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.82 -41.82 83.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . 0.516 HD12 ' N ' ' B' ' 688' ' ' ILE . 2.8 mp -61.93 -42.33 94.31 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.463 ' O ' HG12 ' B' ' 689' ' ' VAL . 60.0 t -68.64 -2.14 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.237 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . 0.49 ' O ' HG22 ' B' ' 693' ' ' ILE . . . -86.33 -55.83 2.4 Favored Glycine 0 C--N 1.351 1.368 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 21.9 m -58.08 -30.79 66.5 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.741 179.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.3 tp -54.71 -34.35 62.26 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.772 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.679 HD11 ' HG3' ' C' ' 696' ' ' ARG . 0.3 OUTLIER -73.91 -27.76 23.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 120.349 -0.541 . . . . 0.0 111.321 -179.334 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.86 -41.65 87.85 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.53 -31.79 64.48 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 121.249 -0.18 . . . . 0.0 111.021 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.98 -30.94 16.39 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 58.9 mt -59.44 -41.53 84.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.085 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 47.4 t -65.28 -28.59 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.496 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.47 -26.66 43.69 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.035 -179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -51.37 -37.04 46.01 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.735 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.27 -42.42 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.547 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.53 -29.09 69.78 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.035 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 20.9 t -57.98 -32.35 67.79 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.609 -0.437 . . . . 0.0 111.279 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 26.1 tp -66.08 -40.94 91.22 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.241 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -64.63 -25.62 38.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.788 0 C-N-CA 120.726 -0.389 . . . . 0.0 110.17 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -67.27 -13.07 61.64 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.433 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.26 -31.74 13.33 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 120.396 0.141 . . . . 0.0 110.671 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.539 HG12 ' O ' ' B' ' 708' ' ' VAL . 20.4 t -87.79 25.96 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.398 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -50.61 117.89 2.73 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 122.148 -0.345 . . . . 0.0 111.29 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.369 -179.998 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.51 ' O ' HD12 ' C' ' 661' ' ' LEU . 4.2 pp -162.58 151.25 14.75 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 120.807 0.337 . . . . 0.0 111.219 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -171.26 179.25 3.04 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.903 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.11 -30.99 71.4 Favored 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.449 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.49 -36.44 78.93 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.651 -0.419 . . . . 0.0 110.845 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 59.1 mmtt -70.43 -42.37 71.66 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.369 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -70.4 -53.99 14.25 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.62 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.58 -37.51 75.93 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.4 t -62.83 -33.46 75.28 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.844 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . 0.581 HD21 HG23 ' C' ' 675' ' ' ILE . 19.9 tp -70.99 -5.28 29.95 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -68.58 -6.11 23.68 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -79.9 -49.64 11.62 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 119.567 -0.853 . . . . 0.0 113.269 -178.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -89.94 -23.77 21.48 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 114.738 1.384 . . . . 0.0 114.738 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 55.17 -10.26 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 178.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -63.9 -54.53 33.28 Favored 'General case' 0 C--N 1.352 0.715 0 CA-C-N 120.465 1.484 . . . . 0.0 112.381 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.581 HG23 HD21 ' C' ' 669' ' ' LEU . 7.9 tp -70.14 -32.81 52.31 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.962 178.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -58.77 -39.07 79.93 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.916 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -59.73 -47.51 85.36 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 120.365 -0.534 . . . . 0.0 109.692 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 19.5 t90 -72.61 -28.27 62.67 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.132 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.419 HD23 HG13 ' C' ' 675' ' ' ILE . 0.2 OUTLIER -67.45 -4.05 10.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.521 -179.113 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -142.48 -179.09 6.09 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 64.58 -11.3 0.13 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.01 -37.07 59.18 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 CA-C-N 119.444 1.02 . . . . 0.0 110.5 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 41.0 mtt85 -60.71 -48.3 82.41 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.886 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.537 ' O ' HD12 ' C' ' 688' ' ' ILE . 97.4 mt -62.7 -44.07 99.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.725 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.434 ' HA ' HD13 ' C' ' 688' ' ' ILE . 0.1 OUTLIER -63.76 -28.53 69.94 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.484 0.49 . . . . 0.0 110.154 178.915 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.599 HG13 HG21 ' B' ' 686' ' ' ILE . 0.9 OUTLIER -58.64 -38.77 73.34 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.832 -178.659 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 45.7 mt -67.11 -42.92 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.268 -178.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.537 HD12 ' O ' ' C' ' 684' ' ' ILE . 4.0 mp -57.97 -41.06 79.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-O 119.477 -0.297 . . . . 0.0 111.772 -178.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.598 ' O ' HD11 ' C' ' 692' ' ' LEU . 38.3 t -67.56 -20.06 25.91 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -176.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -90.77 14.38 63.28 Favored Glycine 0 CA--C 1.545 1.942 0 CA-C-N 119.994 1.27 . . . . 0.0 113.409 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.6 m -88.68 -34.25 17.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.365 1.083 . . . . 0.0 112.418 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . 0.598 HD11 ' O ' ' C' ' 689' ' ' VAL . 0.2 OUTLIER -61.16 -33.09 72.86 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.982 -178.369 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.525 ' H ' HD12 ' C' ' 692' ' ' LEU . 2.1 pp -57.81 -40.05 74.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 119.794 -0.762 . . . . 0.0 110.267 -178.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.9 -53.36 46.98 Favored Glycine 0 CA--C 1.539 1.593 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 7.7 tt -56.63 -31.6 64.49 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.679 ' HG3' HD11 ' B' ' 693' ' ' ILE . 23.6 mmt180 -50.55 -36.52 34.83 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 -178.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.63 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.2 OUTLIER -59.67 -41.64 85.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.582 -177.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.6 -28.87 45.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.64 -35.16 73.84 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.667 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.3 -35.41 65.06 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.148 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 80.4 t -59.54 -31.41 46.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.029 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.4 tp -58.34 -34.29 70.47 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.418 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 29.2 p -58.0 -37.61 74.6 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.561 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.8 tp -57.59 -39.9 77.84 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.671 -0.411 . . . . 0.0 109.946 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 28.9 t -72.82 -31.43 36.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.702 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -60.92 -8.82 3.43 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -109.65 -32.84 6.96 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 39.8 t -82.94 -29.13 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.835 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 . . . . . 0 C--O 1.219 -0.512 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.042 -179.854 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.511 HD22 ' N ' ' A' ' 660' ' ' LEU . 3.6 mm? . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.679 ' O ' HD23 ' C' ' 663' ' ' LEU . 44.4 mt 60.23 115.31 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.144 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -165.65 168.5 16.21 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.208 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.522 ' O ' HD23 ' A' ' 663' ' ' LEU . 5.3 tt -52.52 -38.82 60.47 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.823 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.15 -34.62 68.65 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.518 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -68.18 -44.32 76.16 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.356 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -58.7 -44.1 90.24 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-O 120.815 0.34 . . . . 0.0 110.942 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . 0.462 ' CB ' HD22 ' B' ' 660' ' ' LEU . . . -51.68 -19.66 1.69 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.142 -178.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 32.1 t -64.69 -32.65 74.42 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.421 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 669' ' ' LEU . 4.2 mm? -69.82 -20.49 63.44 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -68.89 -17.22 63.94 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.905 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -63.24 -35.49 80.52 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 3.9 m95 -94.84 -23.44 17.48 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 119.76 -0.776 . . . . 0.0 111.099 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 18.5 t80 66.8 -41.74 0.4 Allowed 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 178.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -52.09 64.32 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -177.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.474 HD11 ' CE3' ' A' ' 678' ' ' TRP . 8.1 tp -62.92 -29.91 48.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.719 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.177 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.4 m -59.69 -37.57 79.16 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.835 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -66.27 -23.16 66.35 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.503 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.474 ' CE3' HD11 ' A' ' 675' ' ' ILE . 4.9 t90 -72.05 -46.4 57.14 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.225 -179.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.11 -24.45 19.12 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -177.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -74.07 -0.59 16.96 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 119.397 -0.921 . . . . 0.0 111.607 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -128.31 -25.07 3.01 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.617 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.4 tt -55.56 -36.6 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.874 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 26.9 ttp-105 -55.84 -48.42 75.52 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 29.3 mt -64.89 -45.97 93.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -52.83 -33.22 48.39 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.9 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.485 HG13 HG21 ' C' ' 686' ' ' ILE . 1.1 mp -58.4 -42.81 85.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 3.7 mm -58.44 -42.14 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 119.907 -0.717 . . . . 0.0 109.564 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 41.8 mm -57.08 -41.01 76.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-N 116.965 -0.107 . . . . 0.0 110.958 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 689' ' ' VAL . 42.8 t -67.75 -0.09 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 C-N-CA 120.158 -0.617 . . . . 0.0 111.495 -178.134 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.97 -40.23 8.18 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 177.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 4.3 m -77.86 -16.92 57.91 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.461 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.5 tp -58.83 -44.04 90.8 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.171 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.729 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.2 OUTLIER -63.0 -30.48 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.231 179.43 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.55 -37.82 78.34 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.335 -1.506 . . . . 0.0 109.335 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.641 ' O ' HG22 ' A' ' 698' ' ' VAL . 0.4 OUTLIER -56.57 -35.97 68.78 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 120.572 0.225 . . . . 0.0 110.752 179.172 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.645 ' HG2' HD11 ' C' ' 693' ' ' ILE . 0.0 OUTLIER -50.55 -33.89 23.48 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 123.249 0.62 . . . . 0.0 111.479 178.308 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 77.3 mt -57.8 -40.08 74.13 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.457 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 695' ' ' LEU . 16.8 m -55.62 -28.21 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 119.227 0.921 . . . . 0.0 110.77 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.451 ' HA ' ' HB3' ' A' ' 702' ' ' LEU . 28.9 m-85 -55.45 -36.43 66.53 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.58 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.77 -48.02 78.83 Favored 'General case' 0 C--O 1.219 -0.553 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.92 -43.78 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . 0.451 ' HB3' ' HA ' ' A' ' 699' ' ' PHE . 0.6 OUTLIER -58.88 -24.81 62.72 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.729 178.629 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.7 -43.16 94.22 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.376 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.0 tp -65.27 -36.71 84.93 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-O 121.085 0.469 . . . . 0.0 110.062 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.61 -36.1 68.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.052 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.88 -8.74 3.34 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.888 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.95 -45.64 49.03 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 120.594 0.235 . . . . 0.0 111.038 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 708' ' ' VAL . 6.9 t -98.78 26.49 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.563 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -36.16 146.26 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 . . . . . 0 C--O 1.219 -0.528 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.164 -179.245 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.477 ' HB2' HD21 ' A' ' 663' ' ' LEU . 39.6 mt . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 49.47 -152.04 0.15 Allowed 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . 0.4 ' HB2' ' HB2' ' B' ' 665' ' ' LYS . 9.8 pt-20 -170.49 65.7 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.32 0.509 . . . . 0.0 111.272 -178.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.614 HD23 ' O ' ' B' ' 663' ' ' LEU . 5.8 tt -66.88 -41.11 87.76 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 119.981 -0.688 . . . . 0.0 111.974 -179.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -74.58 -29.28 61.27 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.092 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . 0.4 ' HB2' ' HB2' ' B' ' 662' ' ' GLU . 1.1 tptm -70.46 -25.46 63.19 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 118.889 -0.577 . . . . 0.0 111.917 -178.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . 0.727 ' CG ' HD12 ' C' ' 661' ' ' LEU . 91.9 m95 -58.91 -50.7 73.05 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 119.051 -1.059 . . . . 0.0 108.435 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.65 -41.89 95.8 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.996 -178.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 37.9 m -65.85 -31.74 72.87 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.52 -0.472 . . . . 0.0 109.911 178.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 29.8 mt -72.46 -4.98 33.61 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.155 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -68.41 -3.0 9.74 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.574 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 29.6 m-20 -89.38 -12.71 39.6 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -178.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -88.92 -22.75 22.95 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.716 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 60.0 -72.38 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -51.74 -52.31 49.63 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.511 HD13 ' O ' ' B' ' 675' ' ' ILE . 0.3 OUTLIER -68.27 -31.12 50.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 119.571 -0.852 . . . . 0.0 110.569 -179.31 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.9 m -58.74 -43.21 90.17 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.96 -37.83 83.77 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.108 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -71.63 -42.08 68.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.045 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.13 -6.57 18.2 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 119.367 -0.933 . . . . 0.0 111.114 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . 0.409 ' O ' ' HB2' ' B' ' 681' ' ' TYR . 1.9 t90 -129.61 176.4 8.02 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 177.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' B' ' 680' ' ' TRP . 96.7 m-85 72.36 -19.48 0.29 Allowed 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 27.2 pt -55.76 -37.05 45.37 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 CA-C-N 118.169 0.44 . . . . 0.0 110.453 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -45.65 91.26 Favored 'General case' 0 C--O 1.219 -0.541 0 O-C-N 123.102 0.251 . . . . 0.0 110.408 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 38.1 mt -67.15 -38.08 80.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.43 -28.87 60.73 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.514 -178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.89 HG21 HD12 ' C' ' 686' ' ' ILE . 22.4 mm -63.8 -41.06 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.842 -178.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . 0.546 ' H ' HD12 ' B' ' 687' ' ' ILE . 3.6 mp -58.82 -42.16 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . 0.604 ' H ' HD12 ' B' ' 688' ' ' ILE . 4.0 mp -62.82 -43.11 98.59 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.46 ' O ' HG12 ' B' ' 689' ' ' VAL . 97.0 t -68.55 -1.93 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.181 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.099 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -89.79 -61.47 1.36 Allowed Glycine 0 C--N 1.349 1.296 0 N-CA-C 110.619 -0.993 . . . . 0.0 110.619 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 2.9 m -53.22 -20.81 4.43 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.127 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.434 HD23 HG21 ' A' ' 693' ' ' ILE . 1.0 OUTLIER -55.21 -32.58 62.37 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 121.247 -0.181 . . . . 0.0 110.841 -179.694 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.437 HG21 ' HB ' ' C' ' 693' ' ' ILE . 2.4 pp -68.5 -38.3 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.075 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . 0.691 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -65.58 -45.07 91.45 Favored Glycine 0 C--O 1.213 -1.195 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.706 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.87 -39.35 74.17 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -50.55 -31.41 15.61 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.691 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.9 tp -59.69 -41.58 85.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 C-N-CA 119.776 -0.77 . . . . 0.0 111.619 -177.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.406 ' O ' HG22 ' B' ' 701' ' ' VAL . 84.1 t -58.99 -28.31 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 121.289 -0.164 . . . . 0.0 111.019 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -24.87 36.62 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.22 -35.08 16.42 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 119.173 -0.441 . . . . 0.0 112.154 -177.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . 0.406 HG22 ' O ' ' B' ' 698' ' ' VAL . 34.8 m -59.24 -36.04 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.029 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.9 tt -68.52 -40.18 80.88 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 31.1 p -59.73 -31.94 70.08 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.711 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . 0.458 HD13 ' O ' ' B' ' 704' ' ' LEU . 0.2 OUTLIER -61.01 -25.59 67.01 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 120.662 -0.415 . . . . 0.0 109.973 179.294 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 59.1 t -90.22 -10.75 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.952 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -65.32 -10.74 35.24 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -73.98 -39.23 63.82 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 119.817 -0.753 . . . . 0.0 110.82 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.466 HG12 ' O ' ' B' ' 708' ' ' VAL . 29.9 t -91.3 -4.42 10.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.342 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 75.8 ttt-85 -57.47 132.97 54.75 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.46 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.888 -179.964 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 119.444 -0.313 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.727 HD12 ' CG ' ' B' ' 666' ' ' TRP . 0.5 OUTLIER -67.84 -84.84 0.02 OUTLIER 'General case' 0 C--N 1.348 0.543 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.54 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . 0.425 ' HG3' HD22 ' C' ' 661' ' ' LEU . 0.0 OUTLIER -175.68 72.45 0.02 OUTLIER 'General case' 0 C--N 1.354 0.773 0 CA-C-N 118.805 0.729 . . . . 0.0 112.283 -179.669 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.774 HD22 ' O ' ' C' ' 663' ' ' LEU . 0.0 OUTLIER -65.29 -40.07 93.35 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.057 179.077 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . 0.763 ' N ' HD13 ' C' ' 663' ' ' LEU . 22.5 t0 -74.37 -29.74 61.68 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -70.57 -29.36 65.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.452 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 37.5 m95 -58.52 -49.61 76.75 Favored 'General case' 0 C--O 1.22 -0.447 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.39 90.86 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.527 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 6.0 m -62.34 -31.02 71.6 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.661 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . 0.472 ' HG ' HG23 ' C' ' 675' ' ' ILE . 9.7 tp -55.36 -16.64 3.74 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.379 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 26.2 m95 -68.66 -15.44 63.52 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.291 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -62.59 -42.75 99.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.149 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.4 m95 -79.93 -22.38 42.77 Favored 'General case' 0 CA--C 1.552 1.048 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 15.5 t80 70.22 -51.94 0.65 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.982 1.265 . . . . 0.0 112.711 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -52.44 63.0 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.472 HG23 ' HG ' ' C' ' 669' ' ' LEU . 6.4 tp -68.44 -30.97 49.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.393 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 94.4 m -63.41 -50.28 70.43 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.844 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -68.6 -44.16 74.9 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 123.354 0.409 . . . . 0.0 110.951 -179.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.425 ' CE3' HD12 ' C' ' 675' ' ' ILE . 10.2 t90 -61.39 -43.56 98.66 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.937 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.577 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.3 OUTLIER -78.92 -33.18 45.72 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.215 -179.22 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 21.9 t90 -59.61 -37.43 78.57 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.97 -178.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . 0.767 ' HB2' HD12 ' C' ' 684' ' ' ILE . 2.3 p90 -123.93 29.93 6.32 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 119.973 -0.691 . . . . 0.0 112.334 -178.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.407 HD13 ' NE1' ' C' ' 678' ' ' TRP . 7.1 tp -55.77 -37.03 45.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.66 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.859 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.0 -34.66 78.5 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.239 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.767 HD12 ' HB2' ' C' ' 681' ' ' TYR . 95.0 mt -62.5 -46.22 96.92 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.556 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.623 ' HA ' HD12 ' C' ' 688' ' ' ILE . 2.3 m-85 -57.99 -29.54 65.34 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.381 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.89 HD12 HG21 ' B' ' 686' ' ' ILE . 21.8 mm -64.01 -44.1 97.76 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.985 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.9 mt -58.96 -41.41 83.03 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.623 HD12 ' HA ' ' C' ' 685' ' ' PHE . 73.9 mt -56.58 -41.53 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 58.7 t -67.63 -31.5 52.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.042 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.19 -38.67 87.47 Favored Glycine 0 C--N 1.353 1.518 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 178.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 10.7 m -78.28 -24.33 46.83 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 117.139 0.47 . . . . 0.0 111.183 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.48 -43.58 96.87 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.217 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.645 HD11 ' HG2' ' A' ' 696' ' ' ARG . 0.6 OUTLIER -61.96 -38.21 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.156 179.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.73 -36.4 89.63 Favored Glycine 0 CA--C 1.544 1.884 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.315 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.487 ' O ' HD23 ' C' ' 695' ' ' LEU . 1.7 tt -55.99 -31.16 62.78 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 117.049 0.425 . . . . 0.0 111.87 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -49.98 -34.76 22.01 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 9.0 tp -58.24 -40.88 79.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.2 p -56.12 -28.93 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 119.551 1.068 . . . . 0.0 110.992 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.58 -35.08 79.77 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.634 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.09 -35.78 64.96 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.522 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 69.9 t -60.0 -31.95 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.118 178.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.87 -30.69 67.93 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.867 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 15.4 m -58.24 -40.49 81.9 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.246 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 16.3 tp -55.95 -26.8 49.63 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.622 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 20.4 t -81.59 -24.65 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.372 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -60.57 -20.83 61.63 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.05 -42.66 59.88 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 120.742 0.305 . . . . 0.0 110.558 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . 0.501 ' O ' HG12 ' C' ' 708' ' ' VAL . 20.4 t -97.32 2.23 10.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.372 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? . . . . . 0 C--O 1.219 -0.529 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.628 179.999 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 2.2 mm? . . . . . 0 N--CA 1.489 1.506 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.836 HD13 ' NE1' ' C' ' 666' ' ' TRP . 7.2 tt 55.4 104.23 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.954 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -139.97 161.38 37.74 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.39 179.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.833 HD13 ' H ' ' A' ' 664' ' ' ASP . 0.0 OUTLIER -62.26 -37.76 86.68 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.128 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . 0.833 ' H ' HD13 ' A' ' 663' ' ' LEU . 37.3 m-20 -74.84 -26.47 59.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.595 178.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.07 -46.07 85.94 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -65.17 -48.27 74.08 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.052 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.32 -28.67 59.65 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.756 -179.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.3 t -62.15 -31.91 72.45 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.165 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.9 mp -72.28 -14.26 61.71 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -68.61 -25.07 64.67 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.608 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 37.9 t-20 -62.55 -36.42 82.58 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.5 m95 -83.36 -22.89 32.69 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.334 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 67.89 -40.13 0.41 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -62.04 -52.34 64.32 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.475 HD12 ' CE3' ' A' ' 678' ' ' TRP . 7.1 tp -68.16 -38.47 79.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 119.872 -0.731 . . . . 0.0 111.048 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -61.87 -44.43 96.84 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 119.933 -0.707 . . . . 0.0 109.579 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -65.52 -37.68 87.45 Favored 'General case' 0 C--O 1.214 -0.787 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.207 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.475 ' CE3' HD12 ' A' ' 675' ' ' ILE . 7.5 t90 -70.72 -34.5 71.98 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.47 HD23 HG13 ' A' ' 675' ' ' ILE . 1.4 mm? -67.64 -3.42 8.96 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 120.468 -0.493 . . . . 0.0 111.456 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.98 150.69 49.35 Favored 'General case' 0 C--O 1.211 -0.966 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 84.08 -23.0 0.19 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.453 0.701 . . . . 0.0 110.473 -178.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.471 HD13 ' HD1' ' A' ' 678' ' ' TRP . 1.4 tp -67.62 -42.93 87.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 21.2 ttp-105 -60.59 -48.07 83.38 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.468 ' HA ' HD12 ' A' ' 687' ' ' ILE . 1.5 mp -59.83 -38.03 74.36 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.13 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.425 ' HA ' HD12 ' A' ' 688' ' ' ILE . 9.0 t80 -52.7 -43.28 65.51 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.527 -178.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.406 HD12 ' N ' ' A' ' 686' ' ' ILE . 1.8 mp -58.29 -37.89 65.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.9 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . 0.468 HD12 ' HA ' ' A' ' 684' ' ' ILE . 81.2 mt -58.17 -43.8 86.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 685' ' ' PHE . 61.2 mt -58.32 -41.43 81.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 177.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.466 HG12 ' O ' ' A' ' 689' ' ' VAL . 43.5 t -67.74 -3.09 2.06 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.348 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -86.29 -53.83 2.86 Favored Glycine 0 C--N 1.349 1.277 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 178.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 15.9 m -61.36 -20.62 63.21 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.735 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.7 tp -54.04 -46.91 72.03 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.593 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.418 HG21 ' HB ' ' B' ' 693' ' ' ILE . 2.1 pp -55.97 -41.21 66.89 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.867 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.84 -51.62 52.11 Favored Glycine 0 C--O 1.214 -1.098 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.572 ' O ' HG12 ' A' ' 698' ' ' VAL . 1.2 tt -60.08 -34.23 73.16 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.993 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.519 ' NE ' HD13 ' C' ' 697' ' ' ILE . 37.9 mmt180 -65.35 -36.41 83.94 Favored 'General case' 0 C--O 1.214 -0.786 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -178.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 4.9 pt -58.98 -40.41 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 CA-C-N 119.708 1.14 . . . . 0.0 112.352 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.824 ' O ' HG22 ' A' ' 701' ' ' VAL . 5.2 p -55.59 -26.79 20.32 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.915 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.33 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -54.27 -33.88 59.62 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.28 -35.53 62.67 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 119.042 -0.504 . . . . 0.0 111.968 -176.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.824 HG22 ' O ' ' A' ' 698' ' ' VAL . 32.9 m -61.09 -31.92 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.481 178.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -24.39 63.93 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.551 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 33.9 m -57.45 -43.11 83.66 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.919 -178.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.2 tp -70.24 -36.45 74.49 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.122 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 56.9 t -60.68 -35.7 65.74 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.568 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -60.94 -21.29 63.28 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.662 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.42 ' HD3' HD21 ' C' ' 704' ' ' LEU . 45.1 mtp85 -101.92 -22.5 14.31 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.435 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.522 ' O ' HG12 ' A' ' 708' ' ' VAL . 17.0 t -108.67 26.15 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.552 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.42 -23.85 52.01 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.474 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.706 -179.917 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.529 HD12 HD23 ' A' ' 663' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.234 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 65.6 mt -137.47 124.3 21.25 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.498 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -151.26 176.51 11.15 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.581 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.604 HD22 ' C ' ' B' ' 663' ' ' LEU . 0.0 OUTLIER -52.19 -18.19 1.4 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.945 179.846 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . 0.458 ' N ' HD22 ' B' ' 663' ' ' LEU . 2.2 m-20 -74.51 -47.97 29.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.243 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -70.24 -38.59 75.21 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.101 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 71.8 m95 -64.96 -37.12 86.61 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.015 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.86 -46.0 88.81 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.171 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 1.9 t -59.76 -31.75 69.94 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.068 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.37 -26.36 52.67 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.174 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . 0.49 ' CE3' HG21 ' B' ' 676' ' ' THR . 98.2 m95 -68.77 -2.86 10.35 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 119.592 -0.843 . . . . 0.0 112.007 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -75.71 -19.09 59.34 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.619 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 5.5 m95 -102.98 -23.2 13.72 Favored 'General case' 0 C--O 1.211 -0.935 0 C-N-CA 120.166 -0.614 . . . . 0.0 111.557 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 64.07 -59.13 0.2 Allowed 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -51.0 -52.39 43.37 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.535 HD12 ' CE3' ' B' ' 678' ' ' TRP . 6.5 tp -68.21 -35.52 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 120.308 -0.557 . . . . 0.0 111.237 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . 0.49 HG21 ' CE3' ' B' ' 670' ' ' TRP . 15.2 m -62.3 -44.75 95.79 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.319 -0.552 . . . . 0.0 110.689 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -66.3 -46.94 75.22 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.535 ' CE3' HD12 ' B' ' 675' ' ' ILE . 1.1 t90 -64.47 -38.68 91.87 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.534 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 8.3 tp -74.27 -20.19 60.23 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -109.4 9.22 25.62 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 120.573 -0.451 . . . . 0.0 112.006 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -123.53 0.5 8.81 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.065 178.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.5 HG12 HD11 ' B' ' 686' ' ' ILE . 11.3 tt -68.24 -37.78 78.57 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 CA-C-N 116.819 -0.173 . . . . 0.0 111.31 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -56.16 -46.62 79.23 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.489 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 78.2 mt -68.07 -38.12 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.332 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.482 ' HA ' HD12 ' B' ' 688' ' ' ILE . 60.3 t80 -64.78 -40.63 95.58 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.971 -179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.5 HD11 HG12 ' B' ' 682' ' ' ILE . 48.2 mt -61.84 -42.29 94.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.934 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.6 mt -59.49 -41.76 85.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.479 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . 0.482 HD12 ' HA ' ' B' ' 685' ' ' PHE . 79.0 mt -56.69 -41.24 74.01 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 28.1 t -67.35 -28.81 43.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 120.222 -0.591 . . . . 0.0 111.706 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.38 -26.32 43.96 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 119.946 -1.121 . . . . 0.0 110.832 178.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 16.7 m -88.1 -30.21 20.03 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 116.783 0.292 . . . . 0.0 111.351 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.72 -32.56 52.45 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 120.635 0.255 . . . . 0.0 110.618 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.667 ' O ' HD12 ' B' ' 693' ' ' ILE . 0.6 OUTLIER -76.0 -27.73 18.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.892 -179.674 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.76 -55.71 20.89 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 119.383 -1.389 . . . . 0.0 113.743 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.639 HD22 ' N ' ' B' ' 696' ' ' ARG . 0.0 OUTLIER -62.62 -29.89 70.95 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 118.138 0.969 . . . . 0.0 113.314 -178.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.639 ' N ' HD22 ' B' ' 695' ' ' LEU . 14.4 mmt180 -49.38 -30.4 7.74 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.725 HD13 ' NH1' ' C' ' 696' ' ' ARG . 43.3 pt -58.35 -38.77 71.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 118.102 0.41 . . . . 0.0 110.796 -178.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.49 HG12 ' O ' ' B' ' 695' ' ' LEU . 3.9 p -54.53 -27.46 17.72 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.37 -177.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -54.9 -26.65 37.27 Favored 'General case' 0 C--O 1.214 -0.77 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.796 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -52.67 -35.64 55.55 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 53.3 t -59.65 -31.34 46.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.54 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 34.1 tp -58.22 -33.89 69.82 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.505 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 7.9 m -58.24 -31.8 67.73 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . 0.516 HD12 ' N ' ' B' ' 704' ' ' LEU . 6.4 mp -77.63 -43.15 32.38 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 33.5 m -93.0 -10.66 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -178.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -60.74 -34.11 73.93 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.439 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.23 -0.73 52.77 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 61.3 t -84.1 -36.05 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 120.594 -0.443 . . . . 0.0 110.062 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -164.95 23.01 0.06 Allowed 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.44 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 118.305 -0.855 . . . . 0.0 112.394 179.86 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.511 ' N ' HD23 ' C' ' 660' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.56 HD23 ' CG ' ' C' ' 665' ' ' LYS . 0.2 OUTLIER -169.25 -38.94 0.02 OUTLIER 'General case' 0 C--O 1.21 -0.975 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.942 -178.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . 0.482 ' HG2' ' H ' ' C' ' 665' ' ' LYS . 0.8 OUTLIER 94.38 148.48 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.976 0.91 . . . . 0.0 109.476 -179.282 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 9.3 tt -52.34 -40.35 61.82 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -176.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -67.05 -39.58 86.93 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.353 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . 0.56 ' CG ' HD23 ' C' ' 661' ' ' LEU . 1.8 tptt -70.68 -43.5 68.95 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.03 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . 0.836 ' NE1' HD13 ' A' ' 661' ' ' LEU . 64.6 m95 -58.85 -48.46 81.28 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.06 -47.32 85.19 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.458 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 2.5 m -61.54 -31.83 71.87 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.337 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 8.8 tp -56.0 -11.51 1.1 Allowed 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -68.68 -18.86 64.34 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -63.87 -44.8 91.99 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . 0.487 ' HB2' HG22 ' C' ' 675' ' ' ILE . 14.1 m95 -79.96 -22.79 42.21 Favored 'General case' 0 CA--C 1.553 1.062 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 65.89 -68.93 0.12 Allowed 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 119.976 1.262 . . . . 0.0 112.435 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -52.15 -51.88 55.21 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.541 HG13 HD23 ' C' ' 679' ' ' LEU . 8.8 tp -67.24 -28.96 44.29 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.961 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 22.4 m -58.94 -48.6 80.91 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.976 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -68.8 -43.94 74.61 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.476 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.49 ' O ' HG23 ' C' ' 682' ' ' ILE . 19.9 t90 -63.49 -19.65 64.93 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . 0.541 HD23 HG13 ' C' ' 675' ' ' ILE . 1.2 mm? -88.97 -2.62 58.67 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.448 -179.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -134.75 -41.33 0.77 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 120.291 -0.563 . . . . 0.0 111.83 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -62.59 -18.1 61.46 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.49 HG23 ' O ' ' C' ' 678' ' ' TRP . 0.2 OUTLIER -56.11 -36.81 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 119.447 -0.901 . . . . 0.0 110.268 179.782 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -62.82 -40.2 96.65 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 38.1 mm -61.68 -46.91 95.53 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.561 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -67.45 -28.46 67.9 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.409 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.36 -43.58 86.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 21.7 mm -67.33 -42.08 87.17 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 C-N-CA 120.324 -0.551 . . . . 0.0 109.665 179.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 95.9 mt -60.69 -41.32 87.82 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.69 -178.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.605 ' O ' HD12 ' C' ' 692' ' ' LEU . 17.2 m -67.45 -10.95 13.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 C-N-CA 119.119 -1.033 . . . . 0.0 112.934 -176.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -91.56 -8.47 63.95 Favored Glycine 0 CA--C 1.559 2.821 0 C-N-CA 120.055 -1.069 . . . . 0.0 114.424 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 75.5 m -88.81 -34.31 17.1 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.322 1.561 . . . . 0.0 112.847 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . 0.838 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -53.73 -31.86 49.92 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.755 -178.15 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.838 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.2 OUTLIER -64.92 -34.76 72.65 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 C-N-CA 121.435 -0.106 . . . . 0.0 111.068 -179.539 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.9 -55.38 31.22 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.611 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.488 ' C ' HD23 ' C' ' 695' ' ' LEU . 8.6 tt -60.72 -46.34 90.78 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.725 ' NH1' HD13 ' B' ' 697' ' ' ILE . 66.1 mtp85 -55.28 -35.78 65.41 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.565 HD11 HD12 ' C' ' 693' ' ' ILE . 68.2 mt -59.23 -41.59 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.497 ' O ' HG22 ' C' ' 701' ' ' VAL . 53.4 t -56.57 -28.09 26.5 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.992 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.209 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . 0.579 ' HA ' HD11 ' C' ' 702' ' ' LEU . 4.5 t80 -55.34 -34.94 64.67 Favored 'General case' 0 C--O 1.206 -1.232 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.99 -36.04 78.39 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -176.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . 0.497 HG22 ' O ' ' C' ' 698' ' ' VAL . 16.6 m -67.79 -39.68 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -176.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . 0.714 HD13 ' H ' ' C' ' 702' ' ' LEU . 0.0 OUTLIER -65.83 -24.12 66.83 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 118.431 -1.308 . . . . 0.0 111.617 -178.821 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . 0.569 ' N ' HD22 ' C' ' 702' ' ' LEU . 57.3 m -59.19 -40.63 86.32 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . 0.42 HD21 ' HD3' ' A' ' 707' ' ' ARG . 15.7 tp -59.06 -27.08 65.19 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 120.295 -0.562 . . . . 0.0 109.911 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 12.3 t -74.27 -26.74 20.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.976 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -60.87 -9.43 4.13 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 5.9 mtt-85 -90.64 -23.91 20.65 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.307 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 49.9 t -91.98 -35.99 7.42 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.548 0 C-N-CA 120.921 -0.311 . . . . 0.0 110.254 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 65.2 ttp85 . . . . . 0 CA--C 1.539 0.527 0 CA-C-O 121.123 0.487 . . . . 0.0 110.607 -179.842 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' C' ' 667' ' ' ALA . 4.2 mm? . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.482 ' O ' HD12 ' C' ' 663' ' ' LEU . 1.9 mm? -122.86 146.81 47.24 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -157.97 170.16 22.95 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.14 -0.624 . . . . 0.0 111.368 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.572 HD21 ' CD2' ' B' ' 660' ' ' LEU . 4.6 tt -61.76 -40.37 94.92 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.386 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -71.27 -26.63 62.97 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.104 -179.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 33.8 mtpt -70.17 -43.87 69.93 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.567 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . 0.475 ' NE1' HD12 ' A' ' 661' ' ' LEU . 89.8 m95 -66.83 -47.98 70.33 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.586 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.36 -30.79 68.66 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 120.471 -0.492 . . . . 0.0 111.01 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.2 t -58.12 -32.47 68.16 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.249 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 25.0 mt -60.01 -11.92 6.89 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.596 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 16.1 m95 -67.93 -42.2 81.39 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.855 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -63.72 -15.4 58.42 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.856 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . 0.556 ' O ' ' N ' ' A' ' 674' ' ' ASP . 93.4 m95 -103.19 16.91 25.34 Favored 'General case' 0 C--O 1.21 -0.99 0 CA-C-O 118.742 -0.647 . . . . 0.0 111.776 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -7.24 -49.91 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 115.47 1.655 . . . . 0.0 115.47 -178.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . 0.556 ' N ' ' O ' ' A' ' 672' ' ' TRP . 25.8 t70 -50.8 -52.34 41.96 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 119.175 -0.44 . . . . 0.0 111.459 179.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.518 HG22 ' HB3' ' A' ' 672' ' ' TRP . 8.5 tp -68.65 -30.74 48.29 Favored 'Isoleucine or valine' 0 C--N 1.354 0.779 0 C-N-CA 119.477 -0.889 . . . . 0.0 111.131 179.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.4 m -59.2 -44.49 92.25 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 58.4 m-80 -60.4 -44.18 95.95 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.475 ' CE3' HD11 ' A' ' 675' ' ' ILE . 54.6 t90 -58.15 -34.86 70.75 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.153 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 53.5 mt -84.6 -2.82 57.99 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -136.29 7.81 3.13 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -179.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -129.52 -27.62 2.37 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 120.197 -0.601 . . . . 0.0 111.769 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.4 HG22 ' O ' ' A' ' 678' ' ' TRP . 16.6 tt -61.49 -37.73 78.47 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.149 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 34.4 ttp-105 -55.75 -48.38 75.34 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 120.292 -0.563 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.439 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.8 mp -60.68 -45.93 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -52.78 -40.91 63.62 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 121.219 -0.192 . . . . 0.0 111.335 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.546 ' CG1' HG21 ' C' ' 686' ' ' ILE . 1.3 mp -58.16 -38.04 65.79 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 CA-C-O 119.24 -0.41 . . . . 0.0 110.544 -179.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.37 -43.26 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.198 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . 0.615 ' H ' HD12 ' A' ' 688' ' ' ILE . 4.0 mp -62.27 -41.46 91.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.614 ' O ' HD11 ' A' ' 692' ' ' LEU . 46.7 t -68.49 3.74 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . 0.417 ' O ' HG22 ' A' ' 693' ' ' ILE . . . -109.31 -9.86 24.83 Favored Glycine 0 CA--C 1.545 1.911 0 C-N-CA 120.911 -0.661 . . . . 0.0 111.492 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.7 m -88.17 -28.66 21.07 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 117.098 0.449 . . . . 0.0 112.051 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.614 HD11 ' O ' ' A' ' 689' ' ' VAL . 0.2 OUTLIER -53.51 -32.32 49.94 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.335 -178.299 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.592 HD11 ' HG2' ' B' ' 696' ' ' ARG . 4.8 tp -53.88 -39.56 40.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.569 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -70.57 -36.97 68.37 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 177.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.572 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.4 OUTLIER -56.65 -31.85 64.77 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.533 -0.334 . . . . 0.0 110.962 179.343 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.514 ' HG3' HD11 ' C' ' 693' ' ' ILE . 30.1 mmt180 -61.61 -35.92 79.26 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 61.1 mt -59.15 -41.38 83.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 CA-C-O 118.973 -0.537 . . . . 0.0 112.092 -176.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.648 ' O ' HG12 ' A' ' 701' ' ' VAL . 5.3 p -56.76 -29.09 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 118.865 0.757 . . . . 0.0 111.473 -179.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -55.68 -35.37 65.94 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.242 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.39 -35.41 65.28 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.383 -178.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 698' ' ' VAL . 1.3 p -59.6 -31.67 47.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 178.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 11.3 tp -58.64 -24.53 61.33 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.796 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 68.4 m -57.57 -43.24 84.4 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.396 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.45 -42.93 99.82 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.57 -34.17 66.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.19 178.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -67.27 -32.14 72.95 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.584 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -73.94 -22.2 59.75 Favored 'General case' 0 C--O 1.219 -0.506 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.556 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 59.6 t -82.97 -36.18 12.82 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.496 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.127 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -142.79 -76.34 0.26 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.374 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.607 179.725 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.572 ' CD2' HD21 ' A' ' 663' ' ' LEU . 4.3 mp . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.81 136.96 53.08 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.597 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -149.82 175.38 11.68 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 123.34 0.4 . . . . 0.0 110.797 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.462 HD23 ' N ' ' B' ' 664' ' ' ASP . 0.2 OUTLIER -64.77 -40.22 94.91 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.792 178.447 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . 0.462 ' N ' HD23 ' B' ' 663' ' ' LEU . 4.4 p-10 -68.97 -26.33 64.98 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.867 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 4.0 tttm -68.85 -41.45 78.44 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.318 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -72.93 -53.58 10.92 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.297 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . 0.518 ' HB2' HD12 ' C' ' 660' ' ' LEU . . . -56.31 -25.84 50.08 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.704 -179.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 53.6 p -58.62 -31.84 68.46 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.898 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.774 HD22 HG21 ' B' ' 675' ' ' ILE . 67.8 mt -71.84 -15.07 62.13 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 18.7 m95 -69.08 -2.4 10.04 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -74.36 -48.16 29.78 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.029 -0.669 . . . . 0.0 110.696 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 6.7 p90 -103.3 -22.49 13.69 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.131 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.02 2.25 0.39 Allowed 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.3 -52.97 59.76 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 118.283 0.492 . . . . 0.0 111.435 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.774 HG21 HD22 ' B' ' 669' ' ' LEU . 6.8 tp -68.21 -31.46 51.71 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.619 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.073 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.1 m -59.2 -43.21 92.24 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.449 -179.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -67.28 -38.58 85.3 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.377 -179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.787 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.9 t90 -72.15 -46.25 57.23 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.635 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . 0.429 HD12 HG13 ' B' ' 675' ' ' ILE . 14.6 mt -75.33 -33.14 61.1 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -84.74 10.46 11.32 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 119.947 -0.701 . . . . 0.0 112.41 -178.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -128.96 -5.55 5.03 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 120.759 -0.377 . . . . 0.0 111.98 179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.787 HG23 ' O ' ' B' ' 678' ' ' TRP . 2.2 pp -67.74 -43.14 86.66 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.713 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.519 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 19.1 mtp-105 -55.88 -47.89 76.55 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.186 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 84.3 mt -67.91 -38.48 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.389 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -55.26 -37.91 67.87 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 121.06 -0.256 . . . . 0.0 111.61 -178.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.943 HG21 HD12 ' C' ' 686' ' ' ILE . 16.2 mm -60.99 -40.81 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.034 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.87 -41.57 83.24 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 32.1 mm -57.51 -42.84 81.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.501 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 48.6 t -68.57 -8.65 10.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.554 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.51 -37.87 13.46 Favored Glycine 0 C--N 1.349 1.259 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.64 -27.59 62.23 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.825 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.13 -54.59 43.31 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.518 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.704 HD11 ' HD3' ' C' ' 696' ' ' ARG . 0.7 OUTLIER -55.57 -28.73 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.917 -179.266 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . 0.526 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -67.35 -50.49 44.18 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 119.46 -1.352 . . . . 0.0 111.235 -179.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.495 ' O ' HG12 ' B' ' 698' ' ' VAL . 2.1 mt -56.76 -31.83 65.0 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.592 ' HG2' HD11 ' A' ' 693' ' ' ILE . 0.6 OUTLIER -50.59 -30.66 13.83 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -179.249 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.526 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.1 tp -58.78 -41.04 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -176.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.495 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.2 p -56.13 -28.11 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-N 118.279 0.491 . . . . 0.0 111.517 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -55.25 -26.84 42.37 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.587 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.48 -36.24 66.39 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 120.402 -0.519 . . . . 0.0 109.832 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 77.9 t -64.82 -41.34 91.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . 0.425 HD23 ' C ' ' B' ' 702' ' ' LEU . 10.4 tt -61.13 -38.34 86.03 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.476 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 24.3 p -59.6 -32.66 70.6 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.273 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.91 -42.33 97.44 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.103 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 59.8 t -63.1 -18.99 22.64 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.954 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.41 -34.05 75.98 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.84 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -73.81 -26.59 60.7 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.546 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 47.2 t -82.85 -36.12 12.9 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.505 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.336 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 29.1 ttt85 -150.36 -67.35 0.2 Allowed 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.824 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.419 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.518 HD12 ' HB2' ' B' ' 667' ' ' ALA . 2.1 tt . . . . . 0 N--CA 1.487 1.384 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.42 -160.67 0.78 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 178.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.79 141.93 26.08 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 119.884 -0.726 . . . . 0.0 110.897 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.495 HD23 ' C ' ' C' ' 663' ' ' LEU . 9.7 tt -61.33 -40.17 93.22 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.924 179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -74.06 -25.7 59.98 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.868 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -67.21 -39.83 86.35 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.974 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -62.25 -50.35 72.07 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . 0.516 ' HB2' ' HG ' ' A' ' 660' ' ' LEU . . . -66.55 -35.62 80.68 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.299 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 59.7 p -57.73 -31.93 66.93 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.073 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 62.7 mt -60.71 -10.1 4.89 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 120.354 -0.538 . . . . 0.0 111.991 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -68.73 -13.24 62.26 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.877 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -62.82 -44.68 95.52 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.981 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -79.8 -12.8 59.75 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 119.638 -0.825 . . . . 0.0 113.146 -177.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.3 t80 69.17 -63.99 0.35 Allowed 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.734 1.152 . . . . 0.0 112.286 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -57.21 -37.56 72.39 Favored 'General case' 0 C--O 1.218 -0.588 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.508 HD12 ' CE3' ' C' ' 678' ' ' TRP . 8.5 tp -67.73 -37.2 78.19 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.885 -179.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 4.4 m -60.97 -49.52 77.12 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.272 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -70.0 -45.07 68.06 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 120.43 -0.508 . . . . 0.0 109.634 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.508 ' CE3' HD12 ' C' ' 675' ' ' ILE . 20.2 t90 -55.89 -23.21 29.94 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.297 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 48.2 mt -94.12 -25.48 17.13 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.448 -0.501 . . . . 0.0 112.148 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -109.27 11.94 25.1 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -122.26 -28.01 4.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.613 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.2 pp -61.2 -41.7 90.55 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.759 0 C-N-CA 120.466 -0.493 . . . . 0.0 111.582 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 31.7 ttp-105 -58.47 -48.29 81.24 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.429 -0.508 . . . . 0.0 111.119 -179.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 78.8 mt -67.67 -43.28 86.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.616 ' HA ' HD12 ' C' ' 688' ' ' ILE . 2.3 m-85 -52.82 -28.18 21.57 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.902 -178.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.943 HD12 HG21 ' B' ' 686' ' ' ILE . 20.8 mm -58.25 -38.05 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.041 -178.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.5 mt -61.3 -42.0 91.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' C' ' 685' ' ' PHE . 68.5 mt -63.49 -41.16 91.7 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.73 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . 0.612 ' O ' HD12 ' C' ' 692' ' ' LEU . 90.2 t -67.18 -26.15 35.66 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 CA-C-O 118.578 -0.725 . . . . 0.0 112.412 -176.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -83.94 2.86 87.03 Favored Glycine 0 CA--C 1.55 2.225 0 C-N-CA 119.855 -1.164 . . . . 0.0 113.046 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 67.6 m -88.98 -34.57 16.8 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.657 1.229 . . . . 0.0 112.603 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . 0.892 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -68.7 -31.93 71.37 Favored 'General case' 0 C--O 1.22 -0.492 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.592 -178.47 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.892 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.1 OUTLIER -63.08 -32.39 56.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.803 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.81 -41.34 99.61 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.495 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.67 ' O ' HG22 ' C' ' 698' ' ' VAL . 0.3 OUTLIER -56.41 -31.47 63.92 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 117.351 0.575 . . . . 0.0 112.389 -179.148 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.704 ' HD3' HD11 ' B' ' 693' ' ' ILE . 0.9 OUTLIER -50.71 -36.18 34.93 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -178.375 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 1.3 pt -59.4 -41.39 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 CA-C-N 119.273 0.942 . . . . 0.0 113.311 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.725 ' O ' HG12 ' C' ' 701' ' ' VAL . 5.2 m -56.41 -27.77 25.2 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.838 0 C-N-CA 119.088 -1.045 . . . . 0.0 111.541 -178.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -54.84 -35.43 63.97 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.838 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.67 66.45 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.952 -179.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . 0.725 HG12 ' O ' ' C' ' 698' ' ' VAL . 2.7 p -59.74 -31.48 47.31 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.961 178.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.7 tp -58.38 -26.2 62.93 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.746 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 2.3 m -58.56 -39.28 79.82 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.054 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 15.5 tp -59.55 -39.47 84.1 Favored 'General case' 0 C--O 1.218 -0.568 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 12.8 t -76.1 -16.79 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.156 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -60.63 -28.24 68.4 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 34.9 ptt85 -78.66 -24.28 45.24 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 120.612 -0.435 . . . . 0.0 111.53 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . 0.527 ' O ' HG12 ' C' ' 708' ' ' VAL . 18.6 t -100.23 26.24 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-O 120.661 0.267 . . . . 0.0 110.795 -179.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 . . . . . 0 N--CA 1.469 0.515 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.867 179.939 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.443 ' N ' HD11 ' C' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.702 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 45.0 mt -132.5 -73.52 0.51 Allowed 'General case' 0 C--O 1.213 -0.816 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.52 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 69.33 147.52 0.06 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.642 0.258 . . . . 0.0 111.034 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . 0.586 ' C ' HD22 ' A' ' 663' ' ' LEU . 0.0 OUTLIER -53.56 -17.59 2.21 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.851 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -73.86 -37.13 64.87 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.042 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -70.29 -42.37 72.15 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.391 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -60.36 -50.06 75.12 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.458 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.99 80.11 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.094 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.2 m -57.44 -32.49 66.96 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.397 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.61 -14.69 45.83 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.882 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -68.44 -8.95 45.27 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.117 -0.633 . . . . 0.0 111.576 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -62.61 -48.02 81.22 Favored 'General case' 0 C--O 1.218 -0.585 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.183 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -102.47 -23.01 13.96 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.016 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 7.2 t80 51.8 6.99 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.81 -52.81 58.51 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 118.873 0.76 . . . . 0.0 111.534 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.445 ' CG2' HD12 ' A' ' 679' ' ' LEU . 41.0 mm -68.39 -42.39 84.07 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.685 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 1.4 m -62.76 -44.81 95.21 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.233 -178.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -59.95 -46.74 88.43 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.304 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.439 ' CZ2' HD12 ' A' ' 682' ' ' ILE . 7.8 t-105 -71.0 -46.51 62.14 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 120.628 -0.429 . . . . 0.0 112.134 -178.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.445 HD12 ' CG2' ' A' ' 675' ' ' ILE . 96.5 mt -74.79 -11.25 60.11 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -176.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -70.35 -3.47 17.53 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 118.927 -1.109 . . . . 0.0 110.884 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -149.44 12.91 0.83 Allowed 'General case' 0 C--N 1.352 0.685 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.22 178.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.439 HD12 ' CZ2' ' A' ' 678' ' ' TRP . 14.9 tt -55.76 -39.63 56.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 118.841 0.746 . . . . 0.0 109.265 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 -70.16 -40.3 74.82 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.495 -0.482 . . . . 0.0 109.779 178.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 31.7 mt -59.73 -42.1 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.63 -37.65 58.82 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.886 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 17.5 mm -58.45 -38.66 71.33 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 C-N-CA 120.214 -0.594 . . . . 0.0 110.344 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.5 -42.91 85.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 56.4 mt -60.63 -42.91 93.51 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.441 HG12 ' O ' ' A' ' 689' ' ' VAL . 57.7 t -68.5 -2.49 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.21 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.883 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -92.94 -34.04 7.03 Favored Glycine 0 C--N 1.352 1.417 0 N-CA-C 109.966 -1.253 . . . . 0.0 109.966 178.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 56.8 m -80.36 -24.87 39.52 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -58.42 -42.62 87.63 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.224 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 3.5 tp -65.3 -28.07 43.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.52 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . 0.604 ' O ' HG22 ' A' ' 697' ' ' ILE . . . -69.83 -51.59 23.77 Favored Glycine 0 C--O 1.212 -1.257 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 178.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.41 -31.84 64.28 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-O 120.491 0.186 . . . . 0.0 110.501 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 0.1 OUTLIER -56.61 -37.24 70.42 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.601 179.725 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . 0.681 HD11 ' HB3' ' B' ' 699' ' ' PHE . 7.3 tp -60.62 -41.2 87.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 119.722 -0.791 . . . . 0.0 110.406 -179.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.623 ' O ' HG22 ' A' ' 701' ' ' VAL . 2.2 t -56.89 -28.97 29.6 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.632 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 13.8 m-85 -58.32 -34.57 70.74 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 178.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.7 -35.72 63.91 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 698' ' ' VAL . 25.1 m -60.62 -36.77 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.766 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 6.2 tt -58.99 -30.5 68.01 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.222 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 38.5 t -58.65 -44.97 90.25 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.794 -179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.52 ' O ' HD23 ' A' ' 704' ' ' LEU . 5.3 tt -66.91 -36.07 81.43 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-O 120.927 0.394 . . . . 0.0 110.112 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 59.7 t -60.59 -26.87 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.695 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -62.59 -34.13 76.37 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 112.322 0.489 . . . . 0.0 112.322 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -80.01 -6.2 57.16 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 120.146 -0.622 . . . . 0.0 112.352 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.525 ' O ' HG12 ' A' ' 708' ' ' VAL . 17.1 t -89.28 25.98 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.508 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 -56.63 112.23 1.23 Allowed 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.441 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 . . . . . 0 C--O 1.219 -0.54 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.999 -179.821 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 4.6 mp . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 mt 54.63 97.68 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.747 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -151.82 -179.69 7.67 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.016 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.9 tt -52.88 -36.15 58.79 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.073 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.05 -37.5 69.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.622 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -46.19 65.5 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.72 -179.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 93.4 m95 -62.57 -38.45 90.13 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.59 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . 0.54 ' HB2' HD22 ' C' ' 660' ' ' LEU . . . -72.05 -31.46 66.16 Favored 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.082 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 6.9 t -57.37 -32.08 66.43 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.409 -0.516 . . . . 0.0 110.292 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.411 ' HG ' ' CH2' ' B' ' 672' ' ' TRP . 5.9 mp -61.0 -15.61 33.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.96 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 9.9 m95 -68.66 -2.97 10.33 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 118.965 -0.541 . . . . 0.0 112.405 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -89.04 -49.57 6.68 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.935 -178.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . 0.411 ' CH2' ' HG ' ' B' ' 669' ' ' LEU . 4.7 p-90 -104.21 -24.15 13.17 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.666 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 2.4 t80 47.5 -4.18 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.336 0 N-CA-C 116.951 2.204 . . . . 0.0 116.951 176.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' B' ' 672' ' ' TRP . 2.7 m-20 -63.73 -54.39 36.23 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 121.061 1.755 . . . . 0.0 113.053 -177.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.426 HD13 ' HA ' ' B' ' 675' ' ' ILE . 10.7 mm -69.91 -27.59 33.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.837 178.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 34.1 m -58.66 -46.81 86.36 Favored 'General case' 0 C--O 1.22 -0.478 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.7 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -65.49 -31.74 72.97 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 120.489 -0.484 . . . . 0.0 109.855 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.49 ' CZ3' HD21 ' B' ' 679' ' ' LEU . 33.8 t90 -67.38 -45.52 76.0 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.113 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . 0.49 HD21 ' CZ3' ' B' ' 678' ' ' TRP . 64.4 mt -81.12 -23.27 38.46 Favored 'General case' 0 C--O 1.22 -0.464 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -177.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 9.3 t90 -92.53 0.62 57.45 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.83 -0.748 . . . . 0.0 112.385 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -130.23 -1.12 4.56 Favored 'General case' 0 C--O 1.218 -0.603 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.572 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 6.4 tp -65.89 -44.1 92.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 C-N-CA 120.512 -0.475 . . . . 0.0 111.664 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.94 -40.03 75.65 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.283 -179.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 92.8 mt -68.17 -43.86 84.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.537 ' HA ' HD13 ' B' ' 688' ' ' ILE . 2.5 m-85 -54.74 -28.4 48.17 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.39 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.493 HG21 HD12 ' C' ' 686' ' ' ILE . 19.0 mm -58.65 -40.36 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.921 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.81 -41.63 83.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . 0.537 HD13 ' HA ' ' B' ' 685' ' ' PHE . 3.7 mp -61.94 -41.46 91.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.214 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 46.5 t -67.8 -10.13 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 120.424 -0.51 . . . . 0.0 112.025 -177.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -77.81 -39.99 23.07 Favored Glycine 0 C--N 1.346 1.112 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 24.2 m -74.07 -17.26 60.98 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.706 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -33.7 68.97 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.27 -179.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.548 HG12 HD13 ' C' ' 692' ' ' LEU . 2.3 pp -70.9 -39.05 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.763 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . 0.551 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -63.41 -42.93 98.94 Favored Glycine 0 C--O 1.217 -0.926 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.412 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.5 OUTLIER -56.26 -31.4 63.54 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 120.584 0.231 . . . . 0.0 111.088 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.511 ' HE ' HD13 ' A' ' 697' ' ' ILE . 1.0 OUTLIER -50.27 -30.48 11.9 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.795 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.551 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.2 tp -58.9 -40.75 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -175.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.412 HG12 ' O ' ' B' ' 695' ' ' LEU . 7.4 p -55.96 -28.74 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 118.912 0.778 . . . . 0.0 111.747 -178.225 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . 0.681 ' HB3' HD11 ' A' ' 697' ' ' ILE . 14.9 m-85 -55.52 -24.17 30.38 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -48.61 -34.63 11.98 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -177.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 33.3 m -58.66 -31.16 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.23 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 39.1 tp -58.24 -35.76 72.2 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.366 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.2 m -58.23 -31.89 67.81 Favored 'General case' 0 C--O 1.218 -0.603 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.689 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . 0.439 HD22 ' N ' ' B' ' 704' ' ' LEU . 3.9 mm? -68.74 -43.5 75.76 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 120.187 -0.605 . . . . 0.0 112.078 -178.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 34.2 m -95.45 -10.3 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -60.62 -15.34 27.21 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 119.832 -0.747 . . . . 0.0 111.662 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . 0.521 ' HG3' HG13 ' B' ' 708' ' ' VAL . 21.3 ptt180 -85.89 -34.39 20.99 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 120.489 -0.484 . . . . 0.0 111.189 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.521 HG13 ' HG3' ' B' ' 707' ' ' ARG . 27.8 m -91.4 26.08 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 120.858 -0.337 . . . . 0.0 111.381 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 23.7 mmt180 -50.8 146.61 5.69 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.185 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.662 -179.982 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.54 HD22 ' HB2' ' B' ' 667' ' ' ALA . 6.1 mp . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . 0.488 HD21 ' CZ2' ' C' ' 666' ' ' TRP . 4.6 tp 53.96 -153.62 0.28 Allowed 'General case' 0 CA--C 1.549 0.94 0 CA-C-O 118.447 -0.787 . . . . 0.0 110.193 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 122.21 168.68 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 125.861 1.664 . . . . 0.0 109.685 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.443 HD11 ' N ' ' A' ' 660' ' ' LEU . 10.2 tt -61.08 -40.07 92.31 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.751 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -72.22 -23.83 61.3 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.862 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -69.05 -41.59 77.42 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.844 -178.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . 0.488 ' CZ2' HD21 ' C' ' 661' ' ' LEU . 94.2 m95 -65.37 -44.08 88.74 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.317 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.09 -30.67 60.17 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.391 -178.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 92.9 p -59.91 -32.79 71.09 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.904 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 32.6 mt -66.59 -6.9 16.93 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -77.2 -17.6 58.38 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -62.77 -50.01 72.72 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 119.009 -1.077 . . . . 0.0 110.953 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . 0.411 ' O ' ' N ' ' C' ' 674' ' ' ASP . 7.7 p90 -96.03 -22.88 17.09 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 43.3 p90 45.45 3.21 0.0 OUTLIER 'General case' 0 C--N 1.364 1.206 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' C' ' 672' ' ' TRP . 7.2 t0 -64.24 -53.63 46.04 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 120.069 1.304 . . . . 0.0 110.463 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 8.4 tp -69.54 -29.23 40.81 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.918 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.357 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.2 m -58.63 -38.03 77.2 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 123.123 0.264 . . . . 0.0 111.393 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -59.97 -47.08 87.3 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 120.009 -0.677 . . . . 0.0 109.947 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.549 ' HD1' HG21 ' C' ' 682' ' ' ILE . 13.1 t90 -72.53 -37.08 68.41 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.238 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -2.45 6.29 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -142.57 153.31 43.42 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-O 122.083 0.944 . . . . 0.0 112.187 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . 0.475 ' HB2' HD12 ' C' ' 684' ' ' ILE . 5.4 p90 56.98 -3.81 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.792 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.4 pp -62.98 -34.88 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 119.572 1.078 . . . . 0.0 109.244 176.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . 0.792 ' N ' HD12 ' C' ' 682' ' ' ILE . 19.1 ttp-105 -54.47 -31.17 55.16 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.117 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . 0.475 HD12 ' HB2' ' C' ' 681' ' ' TYR . 89.5 mt -59.49 -48.08 88.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 120.516 -0.473 . . . . 0.0 109.834 179.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.418 ' HA ' HD13 ' C' ' 688' ' ' ILE . 27.9 m-85 -53.81 -27.96 32.49 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.284 -178.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.493 HD12 HG21 ' B' ' 686' ' ' ILE . 31.4 mm -57.83 -38.09 63.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.942 -177.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.3 -42.11 86.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.418 HD13 ' HA ' ' C' ' 685' ' ' PHE . 3.8 mp -67.97 -41.56 84.74 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.731 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 93.3 t -67.82 -31.09 50.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.312 -178.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -77.42 13.45 11.14 Favored Glycine 0 CA--C 1.543 1.81 0 CA-C-N 120.166 1.348 . . . . 0.0 112.24 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 8.9 m -88.69 -34.13 17.32 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 117.797 0.798 . . . . 0.0 111.569 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . 0.638 HD12 ' H ' ' C' ' 693' ' ' ILE . 0.2 OUTLIER -53.86 -32.46 53.2 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.416 -179.731 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.638 ' H ' HD12 ' C' ' 692' ' ' LEU . 0.2 OUTLIER -55.14 -37.78 44.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.584 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.28 -42.52 97.36 Favored Glycine 0 CA--C 1.537 1.419 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 177.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.689 ' O ' HG22 ' C' ' 698' ' ' VAL . 0.3 OUTLIER -56.46 -30.46 62.92 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 179.534 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -49.75 -36.0 24.26 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -177.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 3.7 pt -59.37 -41.48 84.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 CA-C-N 119.577 1.081 . . . . 0.0 113.551 -176.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.763 ' O ' HG12 ' C' ' 701' ' ' VAL . 12.3 m -56.38 -27.94 25.41 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.894 0 C-N-CA 119.209 -0.996 . . . . 0.0 111.542 -178.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -54.8 -34.83 63.2 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.11 -35.86 65.09 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 119.197 -0.43 . . . . 0.0 111.803 -177.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . 0.763 HG12 ' O ' ' C' ' 698' ' ' VAL . 9.8 p -64.39 -33.08 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.339 178.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.89 -40.48 88.89 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.521 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 16.1 m -60.51 -34.87 74.71 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.348 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 24.8 tp -58.29 -42.83 87.45 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.319 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 19.0 m -85.78 -10.8 11.34 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -61.34 -25.95 67.49 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.546 -0.461 . . . . 0.0 111.789 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -80.07 -21.36 43.48 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 120.455 -0.498 . . . . 0.0 112.252 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 29.5 m -96.12 -29.72 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.0 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.219 -0.507 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.375 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.718 ' CD1' ' HB2' ' C' ' 667' ' ' ALA . 29.1 mt . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.485 HD22 ' NE1' ' C' ' 666' ' ' TRP . 5.5 mp -126.31 -142.51 0.29 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-O 118.647 -0.692 . . . . 0.0 109.841 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . 0.507 ' HA ' HD22 ' B' ' 661' ' ' LEU . 0.8 OUTLIER 73.38 130.94 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.429 1.013 . . . . 0.0 109.096 -178.211 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -19.2 2.35 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.065 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -63.62 -48.44 77.33 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -71.48 -44.43 64.76 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.73 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -58.5 -35.23 71.92 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.577 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -53.75 -47.36 70.73 Favored 'General case' 0 C--O 1.215 -0.756 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.8 t -53.44 -32.56 50.4 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.321 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.462 HD12 HG23 ' A' ' 675' ' ' ILE . 0.0 OUTLIER -78.43 -14.56 59.32 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.22 -179.433 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -68.46 -17.15 64.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.78 -179.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -68.03 -48.6 65.21 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.534 -178.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 4.7 p90 -103.46 -23.15 13.55 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 121.304 -0.158 . . . . 0.0 111.22 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 p90 40.58 18.32 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -63.87 -53.12 55.6 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 118.741 0.701 . . . . 0.0 110.945 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.462 HG23 HD12 ' A' ' 669' ' ' LEU . 7.2 tp -68.86 -27.93 37.71 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.912 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.093 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.0 m -58.96 -39.33 81.36 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.511 -179.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.04 -47.06 86.41 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.597 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . 0.594 ' O ' HG23 ' A' ' 682' ' ' ILE . 4.9 t90 -72.69 -46.25 54.75 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.9 tp -75.41 -33.26 60.95 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -176.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 13.8 t90 -89.92 4.78 48.94 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 119.691 -0.803 . . . . 0.0 112.449 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -125.06 2.54 7.97 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 120.255 -0.578 . . . . 0.0 112.349 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.594 HG23 ' O ' ' A' ' 678' ' ' TRP . 2.6 pp -55.88 -43.34 74.18 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 C-N-CA 119.884 -0.727 . . . . 0.0 110.838 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.574 ' N ' HD12 ' A' ' 682' ' ' ILE . 0.0 OUTLIER -70.46 -48.28 56.62 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 121.114 -0.235 . . . . 0.0 110.698 179.705 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 97.2 mt -60.34 -46.72 94.59 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.361 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -52.76 -28.5 22.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.621 HG13 HD12 ' B' ' 686' ' ' ILE . 27.4 mm -58.12 -42.28 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.652 -178.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 47.7 mt -58.28 -41.73 81.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 120.031 -0.668 . . . . 0.0 109.342 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 36.3 mm -57.18 -41.95 78.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.554 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.435 HG12 ' O ' ' A' ' 689' ' ' VAL . 59.4 t -68.13 -6.42 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.073 0 C-N-CA 120.659 -0.417 . . . . 0.0 111.339 -179.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -70.67 -40.86 65.61 Favored Glycine 0 C--N 1.35 1.338 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 178.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -72.23 -33.46 67.57 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.327 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.68 -47.39 85.53 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.581 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.779 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.1 OUTLIER -67.68 -35.14 71.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.641 -179.341 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -66.2 -40.19 94.77 Favored Glycine 0 CA--C 1.531 1.093 0 N-CA-C 110.039 -1.225 . . . . 0.0 110.039 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.583 ' O ' HD23 ' A' ' 695' ' ' LEU . 3.1 tt -56.62 -31.82 64.68 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 115.665 -0.267 . . . . 0.0 111.486 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -50.79 -35.26 31.08 Favored 'General case' 0 C--O 1.215 -0.763 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 20.5 tt -58.49 -40.53 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -175.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.532 HG22 ' O ' ' A' ' 695' ' ' LEU . 16.0 m -55.69 -28.69 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 119.041 0.837 . . . . 0.0 111.1 -178.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -56.41 -35.93 68.35 Favored 'General case' 0 C--O 1.214 -0.811 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.836 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.55 -50.7 71.11 Favored 'General case' 0 C--O 1.219 -0.511 0 O-C-N 123.262 0.351 . . . . 0.0 111.28 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 22.7 m -68.56 -38.83 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.115 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.1 tt -66.17 -24.64 66.68 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.424 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 68.9 m -61.68 -44.57 96.69 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.757 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.8 tp -64.36 -36.1 83.03 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.065 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 87.4 t -60.79 -36.31 70.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.951 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -60.93 -18.16 55.29 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.883 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 10.2 ttm180 -73.87 -40.32 63.31 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 121.198 -0.201 . . . . 0.0 110.915 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . 0.512 ' O ' HG12 ' A' ' 708' ' ' VAL . 16.3 t -96.14 25.44 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.595 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 42.2 ttm-85 -65.62 123.23 19.13 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.43 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 8.6 mp0 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.629 179.808 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.467 HD12 ' N ' ' B' ' 660' ' ' LEU . 7.8 mp . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 662' ' ' GLU . 19.2 tp 59.77 153.69 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 121.623 0.725 . . . . 0.0 111.565 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . 0.402 ' N ' ' HG ' ' B' ' 661' ' ' LEU . 1.3 mp0 -95.62 42.47 1.09 Allowed 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.224 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . 0.495 HD21 ' N ' ' C' ' 660' ' ' LEU . 7.4 tt -54.6 -41.57 70.09 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.986 -179.052 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -75.07 -34.67 61.83 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.725 178.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 11.5 tmtt? -70.57 -34.56 72.33 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 123.44 0.462 . . . . 0.0 110.766 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -58.6 -54.8 43.0 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . 0.654 ' HB2' ' HG ' ' C' ' 660' ' ' LEU . . . -70.68 -42.96 70.02 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.666 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 37.4 t -54.57 -31.28 56.43 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.358 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.626 HD11 HG23 ' B' ' 675' ' ' ILE . 0.2 OUTLIER -55.58 -25.65 39.37 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.111 -179.27 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -68.52 -2.81 9.62 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.104 -0.638 . . . . 0.0 111.654 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -80.35 -28.7 37.99 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.795 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . 0.489 ' HB2' HG22 ' B' ' 675' ' ' ILE . 7.4 m95 -87.62 -23.14 24.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.521 -179.049 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 66.5 -59.85 0.34 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 178.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -57.44 -52.63 64.59 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -177.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.626 HG23 HD11 ' B' ' 669' ' ' LEU . 5.2 tp -68.54 -34.45 65.49 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.811 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.4 m -60.37 -37.4 80.62 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 120.036 -0.665 . . . . 0.0 110.241 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -59.95 -46.44 89.39 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.759 ' O ' HG23 ' B' ' 682' ' ' ILE . 7.0 t90 -71.64 -30.6 65.93 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.087 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.96 -7.51 58.1 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -118.25 -20.2 8.66 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 120.642 -0.423 . . . . 0.0 112.102 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -95.2 0.87 54.44 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.25 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . 0.759 HG23 ' O ' ' B' ' 678' ' ' TRP . 4.7 pt -56.39 -43.46 77.52 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.839 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 25.9 ttp-105 -55.68 -46.55 77.56 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.812 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.3 mp -67.39 -37.84 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . 0.797 ' HA ' HD12 ' B' ' 688' ' ' ILE . 2.4 t80 -55.32 -41.54 72.56 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.074 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.621 HD12 HG13 ' A' ' 686' ' ' ILE . 3.5 mm -60.95 -45.15 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.373 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 65.7 mt -58.93 -41.48 83.16 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . 0.797 HD12 ' HA ' ' B' ' 685' ' ' PHE . 62.2 mt -56.9 -41.87 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.473 ' O ' HG12 ' B' ' 689' ' ' VAL . 47.0 t -68.37 -2.24 1.87 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.12 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.261 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -83.77 -42.73 7.58 Favored Glycine 0 C--N 1.349 1.274 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 68.0 m -73.43 -21.8 60.37 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.932 -0.307 . . . . 0.0 111.063 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.15 -41.63 75.71 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.453 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.667 ' O ' HD12 ' B' ' 693' ' ' ILE . 0.6 OUTLIER -72.25 -32.78 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.525 -179.654 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . 0.551 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -67.3 -47.01 66.07 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 119.661 -1.257 . . . . 0.0 111.419 -179.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.407 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.4 OUTLIER -56.82 -31.77 65.04 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.732 -179.019 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.697 ' HG3' HD11 ' A' ' 693' ' ' ILE . 37.0 mmt180 -50.63 -31.11 15.12 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . 0.551 HG22 ' O ' ' B' ' 694' ' ' GLY . 19.0 tt -59.42 -41.1 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 N-CA-C 113.129 0.788 . . . . 0.0 113.129 -175.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . 0.522 ' O ' HG22 ' B' ' 701' ' ' VAL . 8.5 p -56.43 -28.72 27.09 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.787 0 CA-C-N 118.474 0.579 . . . . 0.0 111.932 -178.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -55.52 -25.79 39.35 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -50.12 -35.6 26.42 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . 0.522 HG22 ' O ' ' B' ' 698' ' ' VAL . 33.3 m -59.85 -33.38 52.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.595 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 21.2 tp -61.65 -28.06 69.11 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.314 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 17.3 m -57.98 -34.2 69.71 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 120.971 -0.292 . . . . 0.0 111.571 -179.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 14.3 tp -77.93 -42.33 33.4 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.748 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 48.8 t -66.3 -13.58 16.25 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.345 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -60.84 -34.2 74.2 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.973 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 -76.13 -35.68 59.15 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.049 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.516 HG12 ' O ' ' B' ' 708' ' ' VAL . 16.6 t -89.1 26.07 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.521 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -60.15 116.38 4.16 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.554 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.702 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . 0.654 ' HG ' ' HB2' ' B' ' 667' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 5.7 mt -117.39 151.55 36.8 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.013 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -174.0 -177.9 1.42 Allowed 'General case' 0 C--O 1.22 -0.493 0 O-C-N 123.306 0.379 . . . . 0.0 110.186 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.65 -40.13 86.68 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 120.873 0.368 . . . . 0.0 110.454 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.35 -28.99 66.69 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.56 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 32.9 tptt -70.11 -43.29 71.34 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.849 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . 0.485 ' NE1' HD22 ' A' ' 661' ' ' LEU . 88.0 m95 -73.04 -49.16 30.27 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.088 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . 0.718 ' HB2' ' CD1' ' A' ' 660' ' ' LEU . . . -62.18 -14.73 40.55 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.664 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 60.3 p -65.71 -31.69 72.83 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.533 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . 0.461 HD23 HD11 ' C' ' 675' ' ' ILE . 8.6 mp -77.51 -6.06 52.23 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -72.12 -28.55 63.34 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -62.72 -49.89 73.25 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 118.633 -1.227 . . . . 0.0 110.756 -178.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . 0.418 ' O ' ' N ' ' C' ' 674' ' ' ASP . 6.1 p90 -95.86 -23.35 16.95 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 51.6 p90 38.66 19.12 0.0 OUTLIER 'General case' 0 C--N 1.363 1.168 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' C' ' 672' ' ' TRP . 1.0 OUTLIER -64.19 -54.0 40.48 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.448 179.855 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . 0.466 ' C ' HD12 ' C' ' 675' ' ' ILE . 1.5 pp -70.15 -33.56 55.32 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 CA-C-O 121.159 0.504 . . . . 0.0 110.491 177.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 21.0 m -58.64 -33.95 70.64 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.796 -177.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -59.9 -47.94 83.73 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 119.481 -0.888 . . . . 0.0 109.961 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . 0.525 ' HD1' HD11 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -73.43 -46.05 50.86 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.121 178.728 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 2.5 tt -67.62 -33.44 74.98 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 7.5 t90 -80.12 -17.27 53.01 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.4 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -93.03 -6.43 48.27 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.519 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . 0.58 ' O ' HD13 ' C' ' 686' ' ' ILE . 50.2 mm -56.04 -47.6 80.06 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -58.08 -42.01 84.68 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.3 178.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 41.4 mm -61.2 -48.53 88.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.861 -178.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.691 ' HA ' HD12 ' C' ' 688' ' ' ILE . 11.7 m-85 -69.63 -28.87 66.28 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.58 HD13 ' O ' ' C' ' 682' ' ' ILE . 1.2 mp -58.25 -50.04 79.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.584 -178.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 40.5 mt -59.08 -41.36 83.24 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.584 0 C-N-CA 120.36 -0.536 . . . . 0.0 109.629 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' C' ' 685' ' ' PHE . 84.1 mt -56.67 -41.88 75.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.88 -31.41 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.6 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.88 -43.44 92.54 Favored Glycine 0 CA--C 1.537 1.417 0 CA-C-N 119.147 0.885 . . . . 0.0 111.66 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 11.8 m -78.59 -20.31 50.77 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 117.501 0.651 . . . . 0.0 112.122 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.5 tp -59.72 -32.95 71.01 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.096 -178.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.2 pp -65.47 -36.47 77.75 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.38 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.68 -36.84 87.91 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 120.74 -0.743 . . . . 0.0 111.489 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 7.8 tt -56.42 -32.83 65.24 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 117.481 0.64 . . . . 0.0 111.156 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.84 -36.68 38.84 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 120.371 0.129 . . . . 0.0 111.28 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 53.5 mt -59.82 -42.03 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.175 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.544 ' O ' HG12 ' C' ' 701' ' ' VAL . 39.4 t -70.91 -33.5 52.33 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.228 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . 0.437 ' O ' HD23 ' C' ' 702' ' ' LEU . 0.1 OUTLIER -57.9 -35.48 71.1 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.816 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.73 -35.0 65.66 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . 0.544 HG12 ' O ' ' C' ' 698' ' ' VAL . 7.0 p -59.15 -31.83 46.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 119.989 -0.685 . . . . 0.0 111.389 -178.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . 0.437 HD23 ' O ' ' C' ' 699' ' ' PHE . 1.3 pp -58.96 -25.1 63.25 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.672 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 26.1 p -57.86 -40.38 80.02 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.052 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 14.7 tp -59.02 -31.43 68.82 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 120.523 -0.471 . . . . 0.0 109.786 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.7 t -81.09 -38.14 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.976 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -61.1 -8.55 3.52 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -178.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 3.0 ppt_? -81.76 -14.67 56.15 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 45.2 t -83.0 -36.18 12.78 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.262 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 21.2 ptt-85 . . . . . 0 C--O 1.219 -0.53 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.771 -179.856 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 660' ' ' LEU . . . . . 0.498 ' C ' HD12 ' A' ' 661' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.941 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 661' ' ' LEU . . . . . 0.498 HD12 ' C ' ' A' ' 660' ' ' LEU . 10.5 mp -118.76 136.15 54.13 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.662 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -141.98 152.29 43.31 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.072 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.3 tt -61.7 -39.84 92.9 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.141 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -26.27 62.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.618 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 19.1 tptt -70.49 -46.11 64.37 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-O 120.852 0.358 . . . . 0.0 111.182 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 64.1 m95 -71.82 -47.67 51.61 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.142 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 667' ' ' ALA . . . . . 0.594 ' HB2' ' HG ' ' B' ' 660' ' ' LEU . . . -59.54 -39.3 83.51 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 120.305 -0.558 . . . . 0.0 111.608 -178.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 20.5 t -58.4 -32.03 68.24 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.895 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 669' ' ' LEU . . . . . 0.656 HD21 HG22 ' A' ' 675' ' ' ILE . 2.9 tm? -60.15 -25.01 65.18 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.211 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -68.43 -3.11 10.2 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.915 -0.564 . . . . 0.0 112.24 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -74.85 -50.09 18.25 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 119.128 -1.029 . . . . 0.0 112.6 -178.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 672' ' ' TRP . . . . . 0.411 ' HD1' ' H ' ' A' ' 672' ' ' TRP . 1.0 OUTLIER -104.96 -9.86 17.64 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 118.619 0.645 . . . . 0.0 111.798 177.2 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 1.5 t80 52.06 17.17 0.64 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 176.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 674' ' ' ASP . . . . . 0.406 ' HB2' ' CE3' ' A' ' 672' ' ' TRP . 35.4 t70 -63.73 -52.74 59.13 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 675' ' ' ILE . . . . . 0.656 HG22 HD21 ' A' ' 669' ' ' LEU . 0.4 OUTLIER -68.38 -34.61 66.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 119.486 -0.886 . . . . 0.0 111.699 -178.384 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 676' ' ' THR . . . . . 0.496 ' OG1' HD11 ' A' ' 669' ' ' LEU . 0.0 OUTLIER -58.95 -33.78 71.02 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.121 -179.185 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.38 -46.79 87.68 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.153 -178.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -72.9 -46.46 52.54 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 679' ' ' LEU . . . . . 0.455 HD12 HD12 ' A' ' 675' ' ' ILE . 96.2 mt -84.61 -19.74 32.51 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -174.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -83.91 13.57 4.81 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.728 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -130.7 -35.48 1.46 Allowed 'General case' 0 C--N 1.35 0.62 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 682' ' ' ILE . . . . . 0.496 HD13 ' O ' ' A' ' 682' ' ' ILE . 0.0 OUTLIER -55.57 -36.77 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.057 178.629 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -60.18 -48.78 80.29 Favored 'General case' 0 C--N 1.349 0.553 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.14 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.32 -43.32 97.94 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 685' ' ' PHE . . . . . 0.603 ' O ' HG23 ' A' ' 689' ' ' VAL . 10.1 t80 -52.74 -27.67 18.78 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 686' ' ' ILE . . . . . 0.711 ' CD1' HG21 ' C' ' 686' ' ' ILE . 38.7 mm -57.64 -51.57 68.32 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.236 -177.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 687' ' ' ILE . . . . . 0.491 ' H ' HD12 ' A' ' 687' ' ' ILE . 4.2 mp -61.77 -41.65 91.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.253 179.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 90.6 mt -56.54 -40.34 67.81 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.438 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 689' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 685' ' ' PHE . 57.5 t -67.12 -2.14 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 119.905 -0.718 . . . . 0.0 111.22 -177.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -73.99 -49.36 13.36 Favored Glycine 0 C--N 1.349 1.252 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 35.4 m -66.47 -22.48 66.2 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.925 178.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.79 -32.93 54.35 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.312 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 693' ' ' ILE . . . . . 0.454 HG22 HG21 ' C' ' 693' ' ' ILE . 1.3 pp -80.58 -35.62 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.238 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.2 -45.5 95.9 Favored Glycine 0 C--N 1.342 0.911 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.748 ' O ' HG22 ' A' ' 698' ' ' VAL . 1.6 tt -56.57 -42.17 78.17 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 696' ' ' ARG . . . . . 0.456 ' HE ' HD12 ' C' ' 693' ' ' ILE . 54.0 mmt-85 -50.74 -33.92 24.99 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 122.702 0.401 . . . . 0.0 112.001 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 66.9 mt -56.95 -39.98 69.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.765 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 698' ' ' VAL . . . . . 0.748 HG22 ' O ' ' A' ' 695' ' ' LEU . 17.1 m -55.48 -28.19 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 118.874 0.761 . . . . 0.0 110.787 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -57.95 -36.68 72.88 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.678 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.05 -50.44 73.72 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.931 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 701' ' ' VAL . . . . . 0.447 HG12 ' O ' ' A' ' 698' ' ' VAL . 7.6 p -67.2 -36.97 78.25 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.97 -25.75 67.07 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 1.3 m -57.97 -44.36 87.02 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 121.163 -0.215 . . . . 0.0 110.89 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 3.6 tt -73.24 -27.77 61.77 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.096 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 66.2 t -60.87 -29.47 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -60.75 -17.55 49.36 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.421 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 707' ' ' ARG . . . . . 0.44 ' CZ ' ' CZ ' ' C' ' 707' ' ' ARG . 0.0 OUTLIER -73.85 -34.72 64.63 Favored 'General case' 0 C--O 1.219 -0.521 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.799 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 22.0 t -82.82 -26.74 8.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.331 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 66.29 111.49 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 45.1 tp60 . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.414 179.875 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 660' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' A' ' 667' ' ' ALA . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 661' ' ' LEU . . . . . 0.429 HD12 ' H ' ' B' ' 661' ' ' LEU . 8.1 mp -50.47 135.53 22.25 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 121.199 -0.2 . . . . 0.0 110.775 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -157.27 164.42 37.68 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 120.547 -0.461 . . . . 0.0 111.583 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.6 tt -56.08 -40.57 73.81 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.106 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -74.28 -29.41 61.65 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.041 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 665' ' ' LYS . . . . . 0.415 ' O ' HD13 ' B' ' 669' ' ' LEU . 1.1 tmtp? -61.11 -44.29 97.57 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.332 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -69.94 -51.14 35.29 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.8 -23.52 61.58 Favored 'General case' 0 C--O 1.217 -0.633 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 10.5 m -66.11 -31.78 72.84 Favored 'General case' 0 C--O 1.218 -0.582 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.368 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 669' ' ' LEU . . . . . 0.415 HD13 ' O ' ' B' ' 665' ' ' LYS . 4.7 mp -64.74 -22.03 66.89 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.788 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 24.5 m95 -68.7 -9.04 48.01 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -89.11 -47.64 7.96 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -103.14 -12.96 16.99 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 118.496 2.776 . . . . 0.0 118.496 -174.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 673' ' ' PHE . . . . . 0.463 ' HB3' HG22 ' B' ' 675' ' ' ILE . 1.4 t80 -156.75 156.31 33.11 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 122.914 2.597 . . . . 0.0 117.309 -178.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -63.54 -29.42 70.69 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 112.583 -2.098 . . . . 0.0 112.274 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 675' ' ' ILE . . . . . 0.463 HG22 ' HB3' ' B' ' 673' ' ' PHE . 7.2 tp -55.11 -27.0 18.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.58 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -176.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 11.7 m -58.59 -38.95 79.02 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.67 -36.2 70.56 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.381 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 678' ' ' TRP . . . . . 0.458 ' CE3' HD11 ' B' ' 675' ' ' ILE . 34.9 t90 -55.79 -39.76 71.74 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 116.749 -0.205 . . . . 0.0 110.574 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.56 -14.99 59.97 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 680' ' ' TRP . . . . . 0.478 ' HZ3' ' HH ' ' B' ' 681' ' ' TYR . 16.8 t90 -101.84 -4.78 25.71 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -179.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 681' ' ' TYR . . . . . 0.478 ' HH ' ' HZ3' ' B' ' 680' ' ' TRP . 59.8 m-85 -125.7 -2.25 7.29 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 120.328 -0.549 . . . . 0.0 112.108 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 7.1 tp -68.07 -40.39 83.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.999 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -60.35 -43.77 96.16 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.874 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 78.0 mt -68.2 -41.8 84.26 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.594 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -52.98 -28.65 24.84 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.544 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 686' ' ' ILE . . . . . 0.787 HG21 HD12 ' C' ' 686' ' ' ILE . 21.6 mm -59.32 -42.78 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.539 -179.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.4 mt -58.3 -41.78 82.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 688' ' ' ILE . . . . . 0.51 HD12 ' N ' ' B' ' 688' ' ' ILE . 3.0 mp -62.05 -42.01 93.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 689' ' ' VAL . . . . . 0.629 ' O ' HD11 ' B' ' 692' ' ' LEU . 59.3 t -68.89 -0.99 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.324 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -104.93 7.09 44.33 Favored Glycine 0 CA--C 1.541 1.712 0 C-N-CA 120.634 -0.793 . . . . 0.0 111.902 179.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 3.2 m -88.53 -34.35 17.43 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 117.374 0.587 . . . . 0.0 111.348 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 692' ' ' LEU . . . . . 0.629 HD11 ' O ' ' B' ' 689' ' ' VAL . 0.2 OUTLIER -65.3 -32.69 74.48 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.663 -178.71 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 693' ' ' ILE . . . . . 0.822 HD11 ' HG3' ' C' ' 696' ' ' ARG . 0.8 OUTLIER -57.26 -46.16 85.01 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.37 -178.912 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -71.2 -41.66 59.38 Favored Glycine 0 CA--C 1.532 1.111 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 178.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 695' ' ' LEU . . . . . 0.428 HD23 ' C ' ' B' ' 695' ' ' LEU . 10.5 tt -56.58 -34.9 67.61 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.595 -0.302 . . . . 0.0 111.438 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 696' ' ' ARG . . . . . 0.43 HH11 HD13 ' B' ' 693' ' ' ILE . 11.7 mtm105 -50.69 -31.59 16.86 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 42.3 mm -59.62 -41.34 84.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.33 -28.66 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -56.03 -29.21 60.07 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 120.214 -0.594 . . . . 0.0 111.678 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -51.43 -35.92 41.54 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.776 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 79.7 t -60.43 -32.3 50.84 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.851 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.28 -25.82 67.81 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.257 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 23.2 t -57.44 -37.42 72.79 Favored 'General case' 0 C--O 1.22 -0.492 0 C-N-CA 121.14 -0.224 . . . . 0.0 111.24 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 26.0 tp -64.62 -31.47 72.71 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.029 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 22.0 t -88.1 -21.94 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.035 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.04 -25.78 67.16 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.754 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 68.1 mtp85 -73.7 -49.84 23.79 Favored 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 120.614 -0.434 . . . . 0.0 111.114 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 708' ' ' VAL . . . . . 0.529 HG12 ' O ' ' B' ' 708' ' ' VAL . 18.1 t -104.54 26.1 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.545 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -53.92 146.83 13.34 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.628 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.488 179.771 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 50.67 -176.0 0.02 OUTLIER 'General case' 0 C--O 1.215 -0.721 0 CA-C-O 120.615 0.245 . . . . 0.0 111.558 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -159.87 158.84 31.64 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 663' ' ' LEU . . . . . 0.489 HD21 ' HB2' ' A' ' 660' ' ' LEU . 1.7 tm? -62.65 -40.73 97.96 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.245 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -74.53 -24.24 58.94 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.982 178.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -66.84 -39.5 87.63 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.12 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -60.25 -47.97 83.73 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.233 -0.587 . . . . 0.0 110.067 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.34 -29.35 70.39 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.73 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 19.3 t -64.41 -34.18 77.59 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.162 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 6.1 mp -68.68 -4.66 16.49 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -70.77 -28.81 64.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -62.63 -49.64 74.4 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.934 -177.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 672' ' ' TRP . . . . . 0.428 ' O ' ' N ' ' C' ' 674' ' ' ASP . 2.4 p90 -92.93 -22.67 19.08 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 115.635 1.717 . . . . 0.0 115.635 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 20.4 p90 43.28 8.86 0.0 OUTLIER 'General case' 0 C--N 1.359 1.015 0 N-CA-C 115.648 1.721 . . . . 0.0 115.648 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 674' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' C' ' 672' ' ' TRP . 9.2 t70 -64.24 -53.81 43.22 Favored 'General case' 0 C--N 1.349 0.586 0 CA-C-N 120.007 1.276 . . . . 0.0 110.63 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 7.8 tp -69.76 -33.22 55.22 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.718 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.243 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 13.4 m -58.85 -41.89 88.05 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -177.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -63.22 -43.66 97.47 Favored 'General case' 0 C--O 1.213 -0.829 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.297 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 3.1 t90 -72.51 -45.88 57.28 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.62 -27.03 55.57 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -92.93 7.91 42.0 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.52 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -137.51 3.68 2.56 Favored 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 120.507 -0.477 . . . . 0.0 111.858 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 3.9 tp -64.19 -41.89 93.81 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.063 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 4.6 ptt-85 -58.25 -43.45 87.87 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.159 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 82.5 mt -68.23 -39.87 81.82 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 177.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 685' ' ' PHE . . . . . 0.539 ' HA ' HD12 ' C' ' 688' ' ' ILE . 0.4 OUTLIER -53.39 -28.86 31.74 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.07 -179.6 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 686' ' ' ILE . . . . . 0.787 HD12 HG21 ' B' ' 686' ' ' ILE . 24.0 mm -59.78 -44.29 93.6 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.518 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.843 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 54.7 mt -58.22 -41.51 81.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.539 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 688' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' C' ' 685' ' ' PHE . 31.3 mt -57.59 -41.86 80.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 31.2 t -67.96 -31.23 51.11 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 CA-C-O 119.021 -0.514 . . . . 0.0 111.736 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -67.08 -62.22 4.62 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 119.132 0.878 . . . . 0.0 111.001 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.3 m -51.63 -22.27 3.24 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 116.9 0.35 . . . . 0.0 111.405 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 tp -57.46 -32.85 67.36 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.127 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 693' ' ' ILE . . . . . 0.456 HD12 ' HE ' ' A' ' 696' ' ' ARG . 1.2 pt -73.63 -24.86 20.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.392 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.81 -55.13 30.22 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.865 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 695' ' ' LEU . . . . . 0.658 ' O ' HD23 ' C' ' 695' ' ' LEU . 2.1 tt -56.83 -31.96 65.26 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 117.044 0.422 . . . . 0.0 111.945 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 696' ' ' ARG . . . . . 0.822 ' HG3' HD11 ' B' ' 693' ' ' ILE . 6.9 mmt180 -50.57 -34.34 25.34 Favored 'General case' 0 C--O 1.212 -0.885 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 697' ' ' ILE . . . . . 0.715 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.2 OUTLIER -57.66 -40.43 75.33 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 CA-C-O 118.688 -0.673 . . . . 0.0 112.427 -175.361 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 698' ' ' VAL . . . . . 0.499 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.8 p -55.92 -29.2 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 CA-C-N 119.502 1.046 . . . . 0.0 111.185 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 699' ' ' PHE . . . . . 0.417 ' HB2' ' O ' ' C' ' 696' ' ' ARG . 0.3 OUTLIER -56.71 -34.42 67.45 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.722 179.449 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.72 -35.25 63.47 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 119.294 -0.384 . . . . 0.0 111.573 -176.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.68 -32.16 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 120.001 -0.68 . . . . 0.0 109.836 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.26 -28.8 67.06 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.496 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.0 t -63.48 -38.41 91.04 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.364 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 704' ' ' LEU . . . . . 0.432 HD11 ' HE ' ' A' ' 707' ' ' ARG . 15.0 tp -54.9 -30.98 59.59 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.083 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 41.3 t -75.44 -26.44 18.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.41 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -60.65 -16.93 43.99 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 707' ' ' ARG . . . . . 0.44 ' CZ ' ' CZ ' ' A' ' 707' ' ' ARG . 6.7 ptm180 -74.94 -32.38 61.73 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.276 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 35.4 t -82.79 -30.1 8.69 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.187 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 11.5 tpt85 . . . . . 0 CA--C 1.549 0.916 0 CA-C-O 119.264 -0.398 . . . . 0.0 111.958 179.376 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.783 HD11 ' CZ2' ' A' ' 666' ' ' TRP . 12.1 tp -171.22 144.93 2.12 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.339 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -161.59 148.85 14.6 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.261 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.816 HD13 ' N ' ' A' ' 664' ' ' ASP . 0.0 OUTLIER -54.73 -19.73 6.89 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.584 179.156 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . 0.816 ' N ' HD13 ' A' ' 663' ' ' LEU . 9.3 t70 -75.1 -37.56 61.45 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.314 178.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 1.3 ttmm -68.94 -39.6 79.48 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.784 -179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . 0.783 ' CZ2' HD11 ' A' ' 661' ' ' LEU . 75.4 m95 -68.24 -49.74 58.65 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.263 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -69.42 -40.58 77.17 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.128 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 26.1 t -60.93 -35.69 77.37 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.846 178.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.492 HD21 ' C19' ' A' ' 801' ' ' QOJ . 6.6 mt -57.58 -19.88 28.62 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.331 179.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -68.64 -2.84 9.99 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -178.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -64.24 -48.94 73.89 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.37 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.6 -23.12 13.51 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 120.616 -0.433 . . . . 0.0 110.409 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 54.37 1.71 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.987 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -63.92 -53.53 48.9 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 119.217 0.917 . . . . 0.0 111.722 -179.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.516 HD11 ' CE3' ' A' ' 678' ' ' TRP . 8.8 tp -69.28 -32.11 52.35 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.27 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 18.5 m -58.5 -39.13 79.2 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.49 -0.484 . . . . 0.0 109.951 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -60.35 -41.17 93.06 Favored 'General case' 0 C--O 1.211 -0.923 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.516 ' CE3' HD11 ' A' ' 675' ' ' ILE . 76.5 t90 -71.97 -22.16 61.48 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.974 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -86.96 -16.46 35.75 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.69 26.44 5.59 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 119.963 -0.695 . . . . 0.0 112.329 -178.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 14.7 m-85 -130.37 -41.14 1.24 Allowed 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 10.6 tt -66.53 -36.97 78.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.999 -179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.3 -48.38 76.78 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 36.9 mt -60.19 -37.45 73.43 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.899 178.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.472 ' O ' HG23 ' A' ' 689' ' ' VAL . 0.2 OUTLIER -52.11 -28.71 18.72 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 120.866 -0.334 . . . . 0.0 111.861 -178.032 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.718 HD11 ' CG2' ' C' ' 686' ' ' ILE . 1.4 mp -58.68 -50.52 78.86 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 120.303 -0.559 . . . . 0.0 109.948 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 58.1 mt -58.22 -42.01 82.39 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 C-N-CA 120.05 -0.66 . . . . 0.0 109.592 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 88.5 mt -58.88 -41.17 82.1 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 178.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 685' ' ' PHE . 92.3 t -67.37 -17.96 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.018 -179.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.13 -65.04 3.54 Favored Glycine 0 C--N 1.35 1.328 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 178.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 48.7 m -54.51 -29.51 50.63 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 120.575 -0.45 . . . . 0.0 110.772 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.9 tp -55.75 -41.77 74.45 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.926 -179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.629 HD12 ' HG3' ' B' ' 696' ' ' ARG . 0.3 OUTLIER -71.03 -37.08 66.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.114 -179.255 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.73 -40.6 98.68 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 110.124 -1.191 . . . . 0.0 110.124 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.606 ' O ' HD23 ' A' ' 695' ' ' LEU . 3.2 tt -56.44 -31.66 64.15 Favored 'General case' 0 C--O 1.21 -0.986 0 CA-C-O 120.655 0.265 . . . . 0.0 111.549 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 42.1 mmt-85 -50.45 -34.56 25.2 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 113.472 0.915 . . . . 0.0 113.472 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . 0.511 HD12 ' N ' ' A' ' 698' ' ' VAL . 2.4 pp -57.48 -40.38 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -175.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 695' ' ' LEU . 18.9 m -55.81 -28.33 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 C-N-CA 119.263 -0.975 . . . . 0.0 110.965 -178.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 23.7 m-85 -55.65 -36.27 66.85 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.038 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.85 -47.64 79.9 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 63.1 t -66.04 -44.54 92.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 178.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . 0.547 ' O ' HG12 ' A' ' 705' ' ' VAL . 5.8 tt -62.85 -29.51 70.8 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.928 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 35.4 t -64.41 -42.66 95.96 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.9 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.482 HD11 ' HD3' ' C' ' 707' ' ' ARG . 7.6 tp -80.1 -30.03 39.11 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.072 -178.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.547 HG12 ' O ' ' A' ' 702' ' ' LEU . 0.5 OUTLIER -60.77 -22.67 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.542 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -60.72 -24.68 65.86 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.665 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -73.7 -11.59 60.45 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.038 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 61.9 t -107.34 -36.13 3.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 179.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 53.6 ttm-85 -127.91 145.62 50.89 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 118.064 -0.97 . . . . 0.0 110.65 -179.836 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 1.2 pp . . . . . 0 N--CA 1.497 1.914 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.678 HD21 ' CD1' ' A' ' 666' ' ' TRP . 1.2 pt? -162.84 150.61 13.66 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -167.44 -175.87 3.02 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 120.598 -0.441 . . . . 0.0 111.442 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.454 HD21 HD13 ' C' ' 660' ' ' LEU . 10.6 tt -53.55 -40.14 65.3 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.501 -179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -74.35 -30.63 62.09 Favored 'General case' 0 C--N 1.322 -0.592 0 O-C-N 123.481 0.488 . . . . 0.0 112.044 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 5.4 tptp -70.37 -46.36 64.23 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 92.4 m95 -66.92 -39.64 87.42 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.366 -178.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.25 -23.36 67.03 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.742 -179.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -31.97 73.21 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.606 -0.437 . . . . 0.0 110.533 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 61.1 mt -77.45 -4.22 44.33 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 10.7 m0 -68.62 -5.19 18.63 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.983 0.735 . . . . 0.0 112.983 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -89.11 -49.78 6.55 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 119.208 -0.997 . . . . 0.0 111.238 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . 0.423 ' O ' ' N ' ' B' ' 674' ' ' ASP . 1.2 p90 -104.27 -23.62 13.21 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.918 177.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 53.6 p90 34.5 25.73 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.401 1.259 . . . . 0.0 114.401 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . 0.423 ' N ' ' O ' ' B' ' 672' ' ' TRP . 72.5 m-20 -63.65 -53.08 56.98 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 119.786 -0.765 . . . . 0.0 110.848 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 6.6 tp -69.1 -31.58 50.72 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 C-N-CA 120.763 -0.375 . . . . 0.0 111.05 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 3.1 m -58.8 -36.4 74.4 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.681 -179.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -60.49 -45.9 92.06 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.595 -0.442 . . . . 0.0 109.817 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -70.83 -45.97 63.58 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.534 179.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 75.6 mt -67.35 -2.79 6.66 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 119.939 -0.704 . . . . 0.0 111.795 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.3 t90 -117.69 142.78 46.85 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 178.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 55.2 m-85 72.6 13.27 5.34 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 -179.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -36.35 61.16 Favored 'Isoleucine or valine' 0 C--N 1.354 0.764 0 CA-C-N 119.585 1.084 . . . . 0.0 110.419 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 12.8 mtm105 -55.43 -43.76 75.65 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.904 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 88.2 mt -60.45 -42.75 92.28 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 120.427 -0.509 . . . . 0.0 109.753 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 28.1 t80 -55.81 -43.78 77.24 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.32 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.502 HG21 HD11 ' C' ' 686' ' ' ILE . 1.9 mp -59.75 -40.52 82.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 120.267 -0.573 . . . . 0.0 109.644 179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 90.8 mt -58.77 -41.53 82.83 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.482 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 26.0 mm -58.75 -43.94 89.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 178.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 61.3 t -68.45 -9.51 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.161 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -78.08 -39.1 24.55 Favored Glycine 0 C--N 1.351 1.389 0 N-CA-C 110.376 -1.09 . . . . 0.0 110.376 179.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 16.5 m -80.9 -19.83 43.49 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.802 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -60.82 -40.93 94.58 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.665 -0.243 . . . . 0.0 110.901 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.57 HD11 ' HG2' ' C' ' 696' ' ' ARG . 0.8 OUTLIER -60.19 -40.4 83.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 119.215 -0.421 . . . . 0.0 111.579 -179.007 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -68.3 -43.66 78.3 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 119.566 -1.302 . . . . 0.0 111.238 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.492 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.2 OUTLIER -56.92 -38.54 73.02 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 116.906 0.353 . . . . 0.0 111.481 -179.668 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.629 ' HG3' HD12 ' A' ' 693' ' ' ILE . 25.4 mmt180 -50.77 -30.17 13.4 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -179.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 44.8 mm -58.24 -39.85 75.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 119.435 -0.317 . . . . 0.0 111.225 -176.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.658 ' O ' HG22 ' B' ' 701' ' ' VAL . 6.4 p -54.97 -26.95 18.33 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 C-N-CA 120.614 -0.435 . . . . 0.0 111.007 -179.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 19.7 m-85 -54.29 -24.8 20.41 Favored 'General case' 0 N--CA 1.475 0.777 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.57 -34.9 18.93 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 121.337 -0.145 . . . . 0.0 111.092 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . 0.658 HG22 ' O ' ' B' ' 698' ' ' VAL . 35.2 m -59.33 -31.34 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.55 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . 0.487 HD23 ' C ' ' B' ' 702' ' ' LEU . 8.9 tt -58.24 -41.62 84.58 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.592 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 26.7 t -64.82 -37.55 87.99 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 113.74 1.015 . . . . 0.0 113.74 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -55.28 -43.98 75.26 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 -176.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 27.1 m -71.1 -10.8 14.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 C-N-CA 120.022 -0.671 . . . . 0.0 112.676 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.58 -14.05 17.81 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 119.427 -0.909 . . . . 0.0 110.84 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -73.95 -24.04 59.59 Favored 'General case' 0 C--O 1.219 -0.504 0 C-N-CA 121.281 -0.167 . . . . 0.0 111.171 179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 40.2 t -85.28 -36.07 10.58 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.275 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -68.64 -176.38 0.8 Allowed 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.498 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 . . . . . 0 N--CA 1.469 0.48 0 CA-C-O 118.004 -0.998 . . . . 0.0 111.067 179.855 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.454 HD13 HD21 ' B' ' 663' ' ' LEU . 17.7 mt . . . . . 0 N--CA 1.494 1.757 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -85.12 121.87 28.51 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.702 -0.399 . . . . 0.0 111.152 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -162.42 161.43 27.24 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.382 179.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 8.8 tt -52.91 -40.5 63.62 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.114 -0.494 . . . . 0.0 112.133 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 92.2 m-20 -62.98 -31.87 73.08 Favored 'General case' 0 C--N 1.319 -0.729 0 O-C-N 123.834 0.709 . . . . 0.0 111.616 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 17.8 mmtt -69.79 -41.17 75.44 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.047 -179.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.4 m95 -61.92 -49.33 76.61 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.449 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.54 -31.87 72.86 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.431 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 7.6 t -67.88 -32.68 73.33 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 120.604 0.24 . . . . 0.0 111.184 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.545 HD11 HG22 ' C' ' 675' ' ' ILE . 11.2 tp -57.66 -15.86 8.93 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.284 179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -68.7 -2.61 9.63 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 118.981 -0.533 . . . . 0.0 112.35 -179.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 11.9 t30 -65.03 -50.39 66.45 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 119.318 -0.953 . . . . 0.0 112.995 -177.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . 0.411 ' CE3' ' HB2' ' C' ' 674' ' ' ASP . 12.9 p-90 -103.81 6.17 36.45 Favored 'General case' 0 CA--C 1.569 1.682 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 56.6 -29.39 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 118.943 2.942 . . . . 0.0 118.943 175.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . 0.411 ' HB2' ' CE3' ' C' ' 672' ' ' TRP . 0.3 OUTLIER -63.61 -54.6 33.38 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 121.519 1.963 . . . . 0.0 113.336 -175.015 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.657 HG23 HD23 ' C' ' 679' ' ' LEU . 1.6 mm -69.75 -27.77 34.63 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 C-N-CA 119.119 -1.032 . . . . 0.0 110.113 177.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 18.8 m -58.55 -49.82 76.03 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 111.957 0.355 . . . . 0.0 111.957 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -70.15 -42.79 72.08 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 -178.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 13.9 t90 -69.19 -26.48 64.86 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -178.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.657 HD23 HG23 ' C' ' 675' ' ' ILE . 0.7 OUTLIER -69.69 -32.93 71.82 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -178.388 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -126.58 18.43 7.44 Favored 'General case' 0 N--CA 1.481 1.117 0 N-CA-C 114.495 1.295 . . . . 0.0 114.495 -177.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -125.28 0.27 7.73 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.98 177.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 7.0 tp -68.56 -36.16 73.42 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-O 120.599 0.237 . . . . 0.0 111.524 179.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -55.07 -37.14 66.38 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.026 -0.533 . . . . 0.0 112.125 -176.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.416 HD12 ' N ' ' C' ' 684' ' ' ILE . 1.8 mp -63.95 -48.66 85.11 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.828 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -59.22 -30.13 68.02 Favored 'General case' 0 C--O 1.218 -0.575 0 O-C-N 123.387 0.429 . . . . 0.0 111.093 178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.718 ' CG2' HD11 ' A' ' 686' ' ' ILE . 1.0 OUTLIER -58.89 -46.0 91.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.116 -179.272 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 63.8 mt -60.17 -41.68 87.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 120.106 -0.637 . . . . 0.0 109.823 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.567 ' H ' HD12 ' C' ' 688' ' ' ILE . 3.5 mp -57.05 -40.89 75.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 51.2 t -66.95 -17.6 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 119.844 -0.742 . . . . 0.0 111.431 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -70.32 -62.8 3.52 Favored Glycine 0 C--N 1.351 1.384 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.05 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 4.5 m -51.85 -25.39 7.77 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 117.365 0.583 . . . . 0.0 112.01 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.4 tp -53.77 -34.3 58.62 Favored 'General case' 0 C--O 1.217 -0.64 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.001 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.455 HD12 ' C ' ' C' ' 693' ' ' ILE . 1.7 pp -79.18 -33.32 15.63 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.787 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.937 179.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.92 -48.54 85.11 Favored Glycine 0 CA--C 1.543 1.795 0 C-N-CA 120.68 -0.771 . . . . 0.0 111.691 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.549 HD13 ' C ' ' C' ' 695' ' ' LEU . 1.2 tm? -56.57 -31.84 64.62 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -178.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.57 ' HG2' HD11 ' B' ' 693' ' ' ILE . 0.4 OUTLIER -50.5 -34.19 24.17 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.651 0.982 . . . . 0.0 113.651 -179.78 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 20.0 tt -57.64 -41.22 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 CA-C-O 118.639 -0.696 . . . . 0.0 112.681 -174.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.661 ' O ' HG22 ' C' ' 701' ' ' VAL . 5.6 p -56.49 -28.87 27.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.028 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -34.84 69.7 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.303 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.75 -34.83 63.05 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 -175.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . 0.661 HG22 ' O ' ' C' ' 698' ' ' VAL . 35.4 m -59.15 -31.24 45.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.459 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 1.8 tt -58.64 -27.89 65.15 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 120.954 -0.298 . . . . 0.0 110.834 179.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 19.6 m -58.43 -38.33 77.21 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.497 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 14.2 tp -59.43 -35.23 73.64 Favored 'General case' 0 C--O 1.218 -0.584 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.441 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 9.9 t -84.9 -17.87 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.289 -179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.24 -25.92 66.02 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . 0.482 ' HD3' HD11 ' A' ' 704' ' ' LEU . 34.2 mtm105 -73.85 -45.78 48.99 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.96 -179.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 45.3 t -88.61 -12.59 10.13 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.254 -179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.79 163.98 0.05 Allowed 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.691 179.884 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . 0.492 ' C19' HD21 ' A' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . 0.435 ' C28' HD22 ' B' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . 0.441 ' C22' HD13 ' C' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.416 HD12 HD11 ' C' ' 663' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.496 1.842 0 CA-C-O 119.695 -0.193 . . . . 0.0 110.96 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.478 ' N ' HD12 ' A' ' 661' ' ' LEU . 7.6 mp 55.88 177.87 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.527 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -169.92 147.7 3.36 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.269 179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 9.1 tt -61.65 -40.24 94.21 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.528 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -73.98 -23.95 59.54 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.491 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 15.2 tmtt? -64.88 -42.16 95.03 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 121.059 -0.257 . . . . 0.0 111.136 -179.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . 0.565 ' HE1' HD22 ' B' ' 661' ' ' LEU . 91.5 m95 -69.1 -53.27 21.15 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.328 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.55 84.89 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.875 -178.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 40.4 t -58.75 -31.77 68.63 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.743 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.407 ' CD2' HD23 ' A' ' 679' ' ' LEU . 47.7 tp -58.73 -25.68 63.19 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-O 118.901 -0.571 . . . . 0.0 112.306 -178.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -68.29 -5.55 19.18 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 119.045 -1.062 . . . . 0.0 111.429 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -63.1 -40.31 97.27 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.972 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . 0.447 ' HB2' HG22 ' A' ' 675' ' ' ILE . 6.5 m95 -83.42 -22.75 32.59 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.591 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 42.9 t80 64.99 -67.25 0.12 Allowed 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 178.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -56.04 -52.73 63.2 Favored 'General case' 0 C--O 1.22 -0.468 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.584 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -68.58 -28.42 40.13 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.767 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.477 -179.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.0 m -58.97 -46.39 88.18 Favored 'General case' 0 C--O 1.22 -0.468 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.882 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -62.35 -47.38 84.48 Favored 'General case' 0 C--O 1.213 -0.824 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.737 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -64.88 -37.46 87.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.784 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.407 HD23 ' CD2' ' A' ' 669' ' ' LEU . 8.5 tp -67.98 -8.86 40.88 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 112.721 0.638 . . . . 0.0 112.721 -178.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.3 t-105 -139.3 0.86 1.94 Allowed 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -102.5 0.42 33.59 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 119.889 -0.724 . . . . 0.0 112.125 179.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.619 HD12 ' N ' ' A' ' 683' ' ' ARG . 2.8 pp -55.93 -36.84 45.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.628 0 C-N-CA 120.367 -0.533 . . . . 0.0 110.283 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.619 ' N ' HD12 ' A' ' 682' ' ' ILE . 2.1 tmm_? -67.48 -48.51 66.93 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.946 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 86.3 mt -62.74 -43.67 98.87 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.921 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -52.81 -29.07 25.52 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.781 -179.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.698 HG13 HD12 ' B' ' 686' ' ' ILE . 16.9 mm -58.69 -38.97 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.923 -179.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 10.8 mt -58.01 -41.75 81.08 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.905 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 179.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 80.8 mt -56.99 -41.28 77.0 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 177.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 689' ' ' VAL . 43.3 t -68.04 -0.35 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.345 -179.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -81.1 -34.92 25.42 Favored Glycine 0 C--N 1.349 1.272 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 178.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 13.3 m -75.81 -30.74 59.14 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 116.889 0.345 . . . . 0.0 111.101 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.79 -33.12 54.97 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.944 -178.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 1.7 pp -70.58 -37.23 69.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 120.101 -0.64 . . . . 0.0 110.033 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . 0.679 ' O ' HG22 ' A' ' 697' ' ' ILE . . . -59.81 -43.27 98.09 Favored Glycine 0 C--O 1.214 -1.095 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 -179.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.791 ' O ' HG22 ' A' ' 698' ' ' VAL . 0.2 OUTLIER -56.7 -42.19 78.7 Favored 'General case' 0 C--O 1.211 -0.953 0 C-N-CA 120.878 -0.329 . . . . 0.0 110.553 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -50.48 -35.25 28.24 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . 0.694 HD13 ' O ' ' A' ' 697' ' ' ILE . 0.2 OUTLIER -58.18 -40.19 76.37 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.77 -177.093 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.791 HG22 ' O ' ' A' ' 695' ' ' LEU . 13.2 m -55.82 -28.35 23.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 118.384 0.538 . . . . 0.0 110.829 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 48.3 m-85 -58.45 -36.54 73.84 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.505 -0.478 . . . . 0.0 110.651 -179.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.9 -50.81 72.06 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.175 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 698' ' ' VAL . 11.1 p -68.83 -32.08 53.29 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 C-N-CA 120.619 -0.432 . . . . 0.0 110.18 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 5.0 tp -58.77 -27.36 64.91 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.223 178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 48.3 t -58.0 -45.32 87.03 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.804 -0.358 . . . . 0.0 110.423 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.3 -40.97 97.02 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 45.8 t -60.92 -28.39 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.435 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -60.81 -14.8 24.03 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.83 -39.72 63.84 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.702 -0.399 . . . . 0.0 110.435 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.535 ' O ' HG12 ' A' ' 708' ' ' VAL . 28.5 t -105.54 10.43 9.08 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.532 179.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 66.54 -76.07 0.05 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 122.237 -0.29 . . . . 0.0 110.531 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 61.5 mm-40 . . . . . 0 C--O 1.22 -0.475 0 CA-C-O 117.987 -1.006 . . . . 0.0 110.468 179.924 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.423 HD23 ' N ' ' B' ' 661' ' ' LEU . 1.4 tt . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.565 HD22 ' HE1' ' A' ' 666' ' ' TRP . 0.7 OUTLIER 54.13 90.61 0.03 OUTLIER 'General case' 0 C--O 1.22 -0.461 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.933 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -143.79 147.52 34.26 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.398 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.6 HD22 ' C ' ' B' ' 663' ' ' LEU . 0.0 OUTLIER -52.92 -27.4 18.57 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.463 -179.608 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . 0.581 ' H ' HD13 ' B' ' 663' ' ' LEU . 1.3 t70 -74.23 -40.62 62.3 Favored 'General case' 0 C--O 1.22 -0.487 0 O-C-N 123.275 0.359 . . . . 0.0 111.147 179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -65.26 -46.09 81.91 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.393 -179.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -64.92 -43.86 91.4 Favored 'General case' 0 C--O 1.22 -0.498 0 C-N-CA 120.779 -0.369 . . . . 0.0 111.005 -179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . 0.666 ' HB2' HD23 ' C' ' 660' ' ' LEU . . . -63.28 -31.0 72.04 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.311 -179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 34.4 t -55.62 -31.45 62.29 Favored 'General case' 0 C--O 1.219 -0.502 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.892 179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.54 HD23 HG23 ' B' ' 675' ' ' ILE . 11.2 mp -71.44 -8.77 56.01 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -179.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -74.17 -26.79 60.5 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -63.01 -43.8 97.77 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.563 -178.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.22 -23.17 13.64 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.699 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 14.6 t80 50.42 6.27 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 178.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -63.66 -53.84 45.1 Favored 'General case' 0 C--N 1.35 0.609 0 CA-C-N 119.578 1.081 . . . . 0.0 110.992 -179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.54 HG23 HD23 ' B' ' 669' ' ' LEU . 7.0 tp -69.67 -29.83 42.65 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.911 0 C-N-CA 120.39 -0.524 . . . . 0.0 110.844 177.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 13.1 m -59.04 -41.24 87.37 Favored 'General case' 0 C--O 1.214 -0.809 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.716 -178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -62.64 -47.35 84.1 Favored 'General case' 0 C--O 1.216 -0.663 0 C-N-CA 120.244 -0.582 . . . . 0.0 111.268 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.453 ' O ' HG23 ' B' ' 682' ' ' ILE . 3.0 t90 -72.47 -45.48 59.34 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.369 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 8.3 tp -74.47 -29.38 61.42 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -177.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 19.1 t90 -86.77 -14.82 41.22 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 120.152 -0.619 . . . . 0.0 112.016 -179.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 24.4 m-85 -103.94 10.81 36.11 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.238 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.453 HG23 ' O ' ' B' ' 678' ' ' TRP . 30.9 pt -62.64 -41.27 91.55 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.679 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 8.3 ttp-105 -63.69 -45.55 89.53 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.749 -0.381 . . . . 0.0 110.734 -179.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.0 -40.08 82.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 178.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.526 ' O ' HG23 ' B' ' 689' ' ' VAL . 0.7 OUTLIER -53.38 -30.93 42.32 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.473 -179.229 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.698 HD12 HG13 ' A' ' 686' ' ' ILE . 22.5 mm -59.8 -50.06 81.48 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.136 -179.443 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 73.7 mt -62.12 -42.15 93.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 79.6 mt -60.8 -42.67 93.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.657 ' O ' HD11 ' B' ' 692' ' ' LEU . 87.0 t -68.73 -1.67 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.405 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -105.84 6.71 41.02 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.624 178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 38.6 m -88.7 -34.27 17.25 Favored 'General case' 0 C--O 1.218 -0.553 0 CA-C-N 117.414 0.607 . . . . 0.0 111.583 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.657 HD11 ' O ' ' B' ' 689' ' ' VAL . 0.2 OUTLIER -61.07 -35.12 76.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 120.666 -0.413 . . . . 0.0 111.417 -178.669 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.738 HD13 ' O ' ' B' ' 693' ' ' ILE . 0.0 OUTLIER -61.48 -33.54 57.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.535 0 C-N-CA 119.885 -0.726 . . . . 0.0 109.956 -179.916 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . 0.641 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -73.05 -44.06 37.67 Favored Glycine 0 C--O 1.214 -1.103 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 178.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.75 -41.62 77.87 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 121.323 -0.151 . . . . 0.0 110.836 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 28.0 mmt180 -51.03 -31.3 17.93 Favored 'General case' 0 C--O 1.214 -0.773 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.678 HD13 ' O ' ' B' ' 697' ' ' ILE . 0.2 OUTLIER -59.53 -40.68 82.57 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.87 0 C-N-CA 120.6 -0.44 . . . . 0.0 111.26 -177.763 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 54.0 t -56.04 -28.21 24.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-O 119.551 -0.261 . . . . 0.0 110.889 -179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -55.44 -26.82 44.27 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 120.023 -0.671 . . . . 0.0 111.276 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -53.12 -36.82 61.18 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 120.639 -0.424 . . . . 0.0 109.943 178.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.57 -43.15 98.13 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.534 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 8.7 tt -63.33 -40.69 98.01 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.578 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.4 t -60.36 -32.75 71.57 Favored 'General case' 0 C--O 1.22 -0.465 0 C-N-CA 120.72 -0.392 . . . . 0.0 111.287 -179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 17.9 tp -64.86 -40.19 94.74 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 120.343 -0.543 . . . . 0.0 109.86 179.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.76 -19.5 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.684 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -60.85 -17.72 51.78 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 120.879 -0.328 . . . . 0.0 111.718 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 8.6 tpp85 -73.9 -41.43 62.13 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 46.1 t -92.21 -36.25 7.59 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.152 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 18.8 ttm105 -142.74 151.74 41.59 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 120.454 -0.498 . . . . 0.0 110.945 -179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.034 -0.984 . . . . 0.0 111.131 179.871 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.666 HD23 ' HB2' ' B' ' 667' ' ' ALA . 5.2 mp . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.501 HD11 ' HE1' ' C' ' 666' ' ' TRP . 0.3 OUTLIER -85.86 121.01 27.9 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.216 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . 0.47 ' N ' HD13 ' C' ' 661' ' ' LEU . 38.6 tt0 -161.25 162.64 31.18 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.079 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.416 HD11 HD12 ' A' ' 660' ' ' LEU . 9.3 tt -58.03 -40.03 79.84 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.538 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -74.01 -23.95 59.51 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.511 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -44.36 76.08 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.232 -179.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . 0.501 ' HE1' HD11 ' C' ' 661' ' ' LEU . 86.5 m95 -62.67 -49.98 72.98 Favored 'General case' 0 C--O 1.219 -0.535 0 C-N-CA 120.671 -0.412 . . . . 0.0 111.087 -179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.0 -30.56 59.7 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.509 -179.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.8 m -61.59 -32.32 72.42 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.454 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.422 HD11 ' C21' ' C' ' 801' ' ' QOJ . 4.5 mm? -67.32 -8.83 35.42 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 -179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -68.63 -22.39 64.42 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.758 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -63.09 -42.65 99.64 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . 0.531 ' HB2' HG22 ' C' ' 675' ' ' ILE . 2.6 m95 -80.02 -22.75 42.06 Favored 'General case' 0 CA--C 1.558 1.269 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -176.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 63.27 -69.4 0.07 Allowed 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 120.068 1.304 . . . . 0.0 114.204 178.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 20.3 p-10 -50.9 -52.37 42.55 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -176.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.531 HG22 ' HB2' ' C' ' 672' ' ' TRP . 7.3 tp -68.56 -28.49 40.44 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 C-N-CA 120.064 -0.654 . . . . 0.0 111.006 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.6 m -58.81 -43.76 90.64 Favored 'General case' 0 C--O 1.22 -0.475 0 C-N-CA 120.892 -0.323 . . . . 0.0 110.167 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -60.36 -47.02 87.84 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 120.326 -0.549 . . . . 0.0 109.8 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 41.8 t90 -57.55 -41.34 80.81 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.135 179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 53.4 mt -73.62 -19.67 60.8 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 -178.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 14.0 t90 -112.57 1.8 15.97 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 17.5 m-85 -120.74 -7.9 9.53 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.542 179.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 8.0 tp -58.51 -36.62 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 C-N-CA 121.228 -0.189 . . . . 0.0 110.998 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 49.3 ttp180 -55.8 -48.2 75.8 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.455 -179.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.456 HD12 ' N ' ' C' ' 684' ' ' ILE . 2.0 mp -67.77 -46.75 81.85 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.572 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 179.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.411 ' O ' HG23 ' C' ' 689' ' ' VAL . 5.8 m-85 -52.74 -30.03 30.3 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 123.248 0.343 . . . . 0.0 111.067 179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.528 HG23 HD11 ' A' ' 686' ' ' ILE . 1.0 OUTLIER -58.82 -45.79 91.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.496 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 52.7 mt -62.74 -41.65 93.21 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.453 ' N ' HD12 ' C' ' 688' ' ' ILE . 2.1 mp -56.49 -40.89 70.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 179.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.737 ' O ' HD12 ' C' ' 692' ' ' LEU . 87.2 t -66.81 -22.17 29.33 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.017 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.899 -176.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.02 -5.43 87.66 Favored Glycine 0 CA--C 1.555 2.568 0 CA-C-N 119.93 1.241 . . . . 0.0 113.34 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 67.4 m -88.76 -34.5 17.1 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 118.97 1.385 . . . . 0.0 113.046 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . 0.852 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -53.85 -31.68 50.39 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.049 -178.788 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.852 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.2 OUTLIER -62.05 -33.87 60.48 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.717 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 178.904 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.73 -37.14 89.3 Favored Glycine 0 CA--C 1.54 1.626 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 179.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.496 ' O ' HG23 ' C' ' 698' ' ' VAL . 4.1 tt -56.39 -30.85 63.25 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -49.42 -36.3 21.78 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.517 HD12 ' N ' ' C' ' 698' ' ' VAL . 2.2 pp -59.89 -41.92 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 CA-C-N 118.964 0.802 . . . . 0.0 112.609 -177.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.717 ' O ' HG22 ' C' ' 701' ' ' VAL . 0.0 OUTLIER -61.61 -28.85 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 118.523 -1.271 . . . . 0.0 110.282 -179.293 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . 0.406 ' O ' HD23 ' C' ' 702' ' ' LEU . 1.0 OUTLIER -64.45 -35.54 81.26 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 112.596 0.591 . . . . 0.0 112.596 -179.331 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.68 -35.48 66.08 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -176.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . 0.717 HG22 ' O ' ' C' ' 698' ' ' VAL . 34.1 m -59.77 -31.52 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 120.063 -0.655 . . . . 0.0 111.515 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . 0.406 HD23 ' O ' ' C' ' 699' ' ' PHE . 1.5 pp -58.47 -28.77 65.63 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.178 -179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.3 m -58.04 -41.42 83.22 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.337 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 24.9 tp -62.23 -33.56 74.82 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 178.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 23.0 t -69.87 -27.25 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.609 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -60.94 -7.01 2.11 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 64.0 ttt-85 -73.81 -42.51 60.81 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 110.169 -0.308 . . . . 0.0 110.169 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 3.1 t -102.68 26.08 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.673 179.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.54 -78.4 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.694 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.463 179.801 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . 0.5 ' C18' HG21 ' A' ' 675' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . 0.422 ' C21' HD11 ' C' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 45.9 mt . . . . . 0 N--CA 1.495 1.778 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 53.34 -155.93 0.2 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 120.684 -0.407 . . . . 0.0 110.083 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 78.25 168.6 0.21 Allowed 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 117.961 0.346 . . . . 0.0 110.706 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 3.4 tt -52.3 -22.57 4.64 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.204 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 35.5 m-20 -69.47 -45.54 68.77 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.322 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 4.4 tmtt? -70.4 -41.33 73.15 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.7 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . 0.664 ' CD1' HD13 ' B' ' 661' ' ' LEU . 77.2 m95 -64.56 -38.8 92.27 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.116 -179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.68 -47.33 78.82 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 120.293 -0.563 . . . . 0.0 112.487 -178.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 11.5 t -57.39 -32.6 66.98 Favored 'General case' 0 C--O 1.217 -0.638 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.144 179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.468 HD11 ' CG2' ' A' ' 675' ' ' ILE . 15.3 tp -58.76 -23.1 59.47 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.702 -0.681 . . . . 0.0 112.177 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 5.2 m0 -79.22 -2.99 43.62 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 118.274 -0.87 . . . . 0.0 112.954 -177.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -70.23 -50.68 37.34 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 117.987 -1.485 . . . . 0.0 111.906 -177.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -104.9 -22.13 13.2 Favored 'General case' 0 C--O 1.216 -0.686 0 CA-C-O 120.714 0.292 . . . . 0.0 110.546 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 47.9 p90 40.22 23.28 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 114.061 1.134 . . . . 0.0 114.061 178.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -62.81 -52.68 62.23 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 119.735 -0.786 . . . . 0.0 109.51 178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.468 ' CG2' HD11 ' A' ' 669' ' ' LEU . 7.4 tp -68.59 -27.35 35.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.685 178.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 25.8 m -58.03 -36.15 72.32 Favored 'General case' 0 C--N 1.347 0.483 0 C-N-CA 120.367 -0.533 . . . . 0.0 109.719 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -59.94 -47.5 85.56 Favored 'General case' 0 C--O 1.219 -0.5 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 177.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.461 ' O ' HG22 ' A' ' 682' ' ' ILE . 76.6 t90 -61.73 -19.86 62.88 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.224 177.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.5 tp -94.03 -8.5 39.68 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 120.362 -0.535 . . . . 0.0 112.011 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -128.33 21.38 6.16 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 120.367 -0.533 . . . . 0.0 112.123 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -132.41 -40.24 1.0 Allowed 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 178.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.566 HD13 ' O ' ' A' ' 682' ' ' ILE . 0.0 OUTLIER -68.07 -38.77 80.34 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.744 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.242 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 18.1 ttt180 -59.28 -48.17 82.61 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.528 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -62.06 -45.61 98.35 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.61 ' HA ' HD12 ' A' ' 688' ' ' ILE . 1.0 OUTLIER -52.72 -27.56 18.15 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 179.569 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.82 HG23 HG12 ' C' ' 686' ' ' ILE . 32.7 mm -57.33 -50.52 76.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 C-N-CA 120.161 -0.616 . . . . 0.0 110.581 -177.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 44.0 mt -58.94 -42.03 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.827 0 C-N-CA 119.614 -0.834 . . . . 0.0 109.854 178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . 0.61 HD12 ' HA ' ' A' ' 685' ' ' PHE . 81.8 mt -56.65 -40.91 72.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.483 0 N-CA-C 110.424 -0.213 . . . . 0.0 110.424 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 88.8 t -67.25 -16.02 20.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.864 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -72.32 -26.4 72.11 Favored Glycine 0 CA--C 1.539 1.542 0 N-CA-C 110.087 -1.205 . . . . 0.0 110.087 177.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -86.33 -19.84 29.22 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.671 0.236 . . . . 0.0 111.094 179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.39 -40.9 88.08 Favored 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 120.629 -0.428 . . . . 0.0 110.266 -179.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.763 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.1 OUTLIER -68.53 -33.89 62.48 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.185 179.573 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -68.0 -43.22 82.92 Favored Glycine 0 C--O 1.213 -1.203 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.676 ' O ' HD23 ' A' ' 695' ' ' LEU . 4.5 tt -55.96 -31.45 62.99 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-O 121.071 0.462 . . . . 0.0 110.697 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.416 ' HG2' HD11 ' C' ' 693' ' ' ILE . 2.7 tpp180 -50.34 -35.28 27.09 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -58.35 -40.49 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -176.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 695' ' ' LEU . 10.8 m -55.79 -28.02 23.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 119.5 -0.88 . . . . 0.0 111.204 -177.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -55.28 -36.82 66.55 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.644 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.1 -48.92 77.44 Favored 'General case' 0 C--O 1.22 -0.469 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 178.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 88.4 t -65.65 -39.73 85.82 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.708 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . 0.407 ' HA ' HG12 ' A' ' 705' ' ' VAL . 7.2 tt -60.9 -33.1 72.6 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.701 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 21.7 t -64.29 -45.22 88.96 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.208 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 16.5 tp -81.23 -34.09 32.4 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -178.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.407 HG12 ' HA ' ' A' ' 702' ' ' LEU . 1.8 p -60.87 -18.67 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.697 -178.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -66.26 -12.51 56.76 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 6.0 ptt180 -73.78 -38.58 64.61 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.381 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 2.8 m -95.87 23.53 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.135 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 29.6 ttm180 -96.94 -59.16 1.86 Allowed 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 46.4 tt0 . . . . . 0 C--O 1.22 -0.473 0 CA-C-O 117.825 -1.084 . . . . 0.0 110.095 179.842 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.505 ' C ' HD12 ' B' ' 661' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.664 HD13 ' CD1' ' A' ' 666' ' ' TRP . 6.7 mp -125.64 92.33 3.58 Favored 'General case' 0 C--N 1.347 0.48 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.217 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -140.09 160.89 38.93 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.295 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.73 -39.94 68.77 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.688 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -72.63 -32.23 65.75 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.848 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.35 -46.2 64.62 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -72.81 -32.53 65.6 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 120.54 -0.464 . . . . 0.0 111.383 -178.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.77 -38.12 79.83 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 119.813 -0.755 . . . . 0.0 110.676 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 26.5 t -59.63 -32.39 70.39 Favored 'General case' 0 C--O 1.218 -0.602 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.817 179.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 7.9 mt -57.57 -19.41 25.39 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.94 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 65.2 m95 -68.69 -2.88 10.22 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 119.909 -0.716 . . . . 0.0 112.511 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 84.7 m-20 -81.39 -49.43 10.67 Favored 'General case' 0 C--N 1.347 0.489 0 C-N-CA 119.272 -0.971 . . . . 0.0 110.918 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.1 p90 -104.23 -23.08 13.29 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.516 177.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 49.7 p90 38.05 25.33 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 178.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -63.63 -53.59 49.02 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 119.849 -0.74 . . . . 0.0 110.606 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 5.8 tp -69.17 -41.22 81.26 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.394 179.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.2 m -59.01 -50.57 73.58 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.586 -178.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -65.52 -33.39 75.81 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 120.061 -0.655 . . . . 0.0 111.029 -179.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.454 ' O ' HG12 ' B' ' 682' ' ' ILE . 15.1 t-105 -72.13 -47.12 53.45 Favored 'General case' 0 C--O 1.209 -1.058 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.676 HD22 HG13 ' B' ' 682' ' ' ILE . 0.2 OUTLIER -86.43 -17.14 35.07 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -176.857 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 4.2 t90 -69.49 0.72 4.83 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.718 179.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 84.9 m-85 -126.71 -17.19 5.06 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.676 HG13 HD22 ' B' ' 679' ' ' LEU . 49.3 mm -59.34 -46.21 92.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 119.113 -0.47 . . . . 0.0 112.049 -179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 7.4 ptt-85 -56.51 -44.04 80.35 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.222 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 86.4 mt -67.73 -42.92 86.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 N-CA-C 109.57 -0.53 . . . . 0.0 109.57 178.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.604 ' HA ' HD12 ' B' ' 688' ' ' ILE . 0.3 OUTLIER -53.26 -28.18 26.31 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.989 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.701 HG21 HD11 ' C' ' 686' ' ' ILE . 29.9 mm -58.15 -49.7 80.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 C-N-CA 120.864 -0.335 . . . . 0.0 111.132 -178.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 49.9 mt -57.57 -41.73 79.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . 0.604 HD12 ' HA ' ' B' ' 685' ' ' PHE . 61.3 mt -58.1 -42.06 82.12 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 C-N-CA 120.437 -0.505 . . . . 0.0 110.204 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.485 ' O ' HG12 ' B' ' 689' ' ' VAL . 57.4 t -68.61 -3.04 2.29 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.17 0 C-N-CA 120.6 -0.44 . . . . 0.0 112.013 -179.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.92 -36.83 10.79 Favored Glycine 0 C--N 1.346 1.096 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.54 179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 71.0 m -75.09 -27.04 59.73 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 117.077 0.439 . . . . 0.0 111.045 179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.1 mp -53.5 -32.22 49.41 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.982 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 1.6 pp -74.7 -38.17 44.35 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.712 0 C-N-CA 119.886 -0.725 . . . . 0.0 111.155 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.47 -55.24 28.57 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.584 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.709 HD22 ' C ' ' B' ' 695' ' ' LEU . 0.0 OUTLIER -56.56 -28.32 59.9 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 117.298 0.549 . . . . 0.0 111.988 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.518 ' HE ' HD11 ' A' ' 693' ' ' ILE . 0.2 OUTLIER -46.68 -28.49 1.5 Allowed 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 123.022 0.529 . . . . 0.0 112.089 -177.261 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 6.9 tp -57.33 -39.17 66.31 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.217 0 CA-C-O 118.958 -0.544 . . . . 0.0 111.553 -177.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.674 HG22 ' O ' ' B' ' 695' ' ' LEU . 28.7 m -54.88 -28.28 19.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-N 119.124 0.875 . . . . 0.0 111.548 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 38.6 m-85 -55.21 -25.8 35.34 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -50.5 -50.16 53.63 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 120.64 -0.424 . . . . 0.0 111.503 -179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . 0.494 HG22 ' O ' ' B' ' 698' ' ' VAL . 31.0 m -68.03 -32.06 54.55 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.617 0 C-N-CA 120.138 -0.625 . . . . 0.0 110.646 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 7.1 tt -63.46 -26.97 68.97 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 120.963 -0.295 . . . . 0.0 110.586 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 40.2 m -63.29 -34.49 77.8 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.285 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 20.0 tp -61.83 -43.19 99.34 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.109 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 81.3 t -65.45 -10.93 11.15 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.942 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.124 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -76.82 -21.65 54.76 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.633 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.46 -38.97 16.78 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 121.367 -0.133 . . . . 0.0 111.019 -179.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.508 ' O ' HG22 ' B' ' 708' ' ' VAL . 11.4 p -88.15 25.55 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.301 -178.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 46.7 ttt85 -60.07 138.78 57.8 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.503 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 . . . . . 0 C--O 1.22 -0.491 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.705 -179.866 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.4 mm? . . . . . 0 N--CA 1.493 1.721 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.472 HD11 ' CZ2' ' C' ' 666' ' ' TRP . 0.1 OUTLIER -48.88 134.92 16.18 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-N 116.629 -0.259 . . . . 0.0 110.951 -179.442 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -168.55 151.84 5.49 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.081 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.696 HD22 ' N ' ' C' ' 664' ' ' ASP . 0.0 OUTLIER -56.67 -29.18 62.06 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.288 -0.565 . . . . 0.0 112.264 -179.166 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . 0.696 ' N ' HD22 ' C' ' 663' ' ' LEU . 4.8 t70 -74.17 -27.19 60.71 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.677 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.89 -39.25 76.37 Favored 'General case' 0 C--O 1.219 -0.535 0 O-C-N 123.355 0.409 . . . . 0.0 110.812 -179.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . 0.472 ' CZ2' HD11 ' C' ' 661' ' ' LEU . 79.8 m95 -63.69 -52.16 61.84 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.4 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -51.89 -34.34 40.84 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 37.4 m -59.12 -34.41 72.01 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.481 -0.488 . . . . 0.0 110.944 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 10.8 mp -78.07 -9.71 59.27 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 11.7 m0 -68.66 -26.24 65.21 Favored 'General case' 0 C--O 1.219 -0.553 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.115 178.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -62.78 -42.61 99.78 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -79.58 -22.17 44.09 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.805 1.039 . . . . 0.0 113.805 -177.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 69.08 -44.2 0.53 Allowed 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.895 1.225 . . . . 0.0 113.063 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -57.56 -52.8 63.93 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 118.431 0.56 . . . . 0.0 111.585 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.61 -30.34 46.95 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.531 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.2 m -58.73 -45.24 90.08 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.577 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -78.42 -22.37 47.85 Favored 'General case' 0 C--O 1.217 -0.632 0 C-N-CA 120.527 -0.469 . . . . 0.0 110.932 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 28.3 t90 -56.37 -22.12 29.15 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.143 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -94.27 -33.15 13.35 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.903 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . 0.46 ' O ' HD12 ' C' ' 684' ' ' ILE . 0.0 OUTLIER -97.89 24.37 7.0 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 120.57 -0.452 . . . . 0.0 111.632 -179.266 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 15.1 m-85 -133.03 -39.4 0.95 Allowed 'General case' 0 C--O 1.213 -0.818 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.559 HD13 ' C ' ' C' ' 682' ' ' ILE . 0.0 OUTLIER -61.15 -45.62 98.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.51 0 CA-C-N 116.325 -0.398 . . . . 0.0 109.99 178.498 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 30.8 ttp180 -59.29 -46.71 87.82 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 121.237 0.541 . . . . 0.0 110.257 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.46 HD12 ' O ' ' C' ' 680' ' ' TRP . 80.0 mt -67.88 -36.47 75.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.468 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.41 -28.98 14.33 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -175.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.82 HG12 HG23 ' A' ' 686' ' ' ILE . 2.2 mp -60.03 -39.98 81.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 119.474 -0.891 . . . . 0.0 109.059 178.35 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 46.5 mt -58.72 -41.51 82.61 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 34.3 mm -59.8 -44.15 93.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.526 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 53.6 t -68.18 -24.15 29.62 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.118 0 CA-C-O 118.924 -0.56 . . . . 0.0 112.149 -179.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.6 -61.23 7.72 Favored Glycine 0 C--N 1.354 1.535 0 N-CA-C 110.149 -1.181 . . . . 0.0 110.149 179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 45.4 m -57.33 -31.52 65.78 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.524 -0.47 . . . . 0.0 110.585 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -60.8 -47.17 87.54 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.676 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.693 ' O ' HD13 ' C' ' 693' ' ' ILE . 0.2 OUTLIER -73.09 -34.34 44.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 119.986 -0.685 . . . . 0.0 109.959 179.562 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.82 -43.4 96.59 Favored Glycine 0 CA--C 1.54 1.628 0 C-N-CA 120.665 -0.778 . . . . 0.0 111.335 179.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.779 HD22 ' O ' ' C' ' 695' ' ' LEU . 0.1 OUTLIER -56.22 -31.29 63.36 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-N 117.004 0.402 . . . . 0.0 110.572 -179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.406 ' N ' HD13 ' C' ' 695' ' ' LEU . 21.6 mmm180 -49.81 -34.69 20.32 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.727 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.2 OUTLIER -57.89 -40.12 74.73 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 -175.225 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.465 HG12 ' O ' ' C' ' 695' ' ' LEU . 8.7 p -54.9 -28.43 20.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 119.465 -0.894 . . . . 0.0 111.148 -177.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -60.32 -35.68 76.19 Favored 'General case' 0 C--O 1.216 -0.688 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.05 -39.08 71.48 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.817 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 86.2 t -62.49 -31.86 53.32 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.115 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 12.7 tp -58.69 -37.03 75.19 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.452 179.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 10.3 p -57.83 -35.56 71.05 Favored 'General case' 0 C--O 1.219 -0.521 0 C-N-CA 120.756 -0.378 . . . . 0.0 110.844 -179.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.6 tp -58.86 -37.04 75.63 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.811 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 16.3 t -76.28 -16.23 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.201 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -63.12 -28.87 70.36 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . 0.536 ' HG3' HG13 ' C' ' 708' ' ' VAL . 48.2 ptt85 -86.42 -37.36 18.42 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.314 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . 0.536 HG13 ' HG3' ' C' ' 707' ' ' ARG . 33.6 m -90.95 -1.76 9.98 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 112.276 0.472 . . . . 0.0 112.276 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 12.9 mmp_? 54.55 178.72 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.718 179.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.597 179.992 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . 0.46 ' C17' HD12 ' A' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . 0.401 ' C30' HD11 ' B' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 660' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.475 HD12 ' CD1' ' C' ' 666' ' ' TRP . 34.0 mt -74.78 177.92 5.85 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -169.75 168.94 8.73 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.183 -0.607 . . . . 0.0 111.417 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.434 HD11 ' N ' ' B' ' 660' ' ' LEU . 8.9 tt -61.59 -40.14 93.72 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.671 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.19 -24.43 62.23 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.738 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -66.54 -46.03 77.48 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.977 -0.289 . . . . 0.0 111.244 -179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -73.19 -51.96 15.89 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.21 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . 0.478 ' HB2' HD22 ' B' ' 660' ' ' LEU . . . -58.38 -22.63 54.49 Favored 'General case' 0 C--O 1.22 -0.47 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.772 -179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 13.6 t -60.41 -32.58 71.48 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.298 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.536 HD22 ' N ' ' A' ' 669' ' ' LEU . 3.3 mm? -71.4 -14.22 62.1 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 120.41 -0.516 . . . . 0.0 112.061 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 18.0 m95 -68.97 -12.69 61.9 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.95 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 -62.65 -48.23 80.22 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.231 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.71 -22.61 15.32 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.094 179.409 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 9.7 t80 59.02 -0.34 0.14 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 179.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -63.53 -53.03 58.26 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 118.894 0.77 . . . . 0.0 110.867 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.52 ' O ' HD13 ' A' ' 675' ' ' ILE . 0.3 OUTLIER -69.05 -31.61 51.0 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.826 179.159 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.3 m -58.69 -44.95 90.44 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 116.474 -0.33 . . . . 0.0 110.76 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -60.64 -41.55 95.16 Favored 'General case' 0 C--O 1.215 -0.721 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.589 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 11.1 t90 -71.17 -27.66 63.69 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.375 179.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -90.5 -15.15 31.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -179.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -111.13 -5.26 14.78 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -118.42 -11.11 10.03 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.569 179.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 15.3 tt -66.83 -38.91 82.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.509 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.748 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -56.48 -48.33 77.35 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 120.056 -0.657 . . . . 0.0 109.436 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 82.0 mt -63.7 -46.88 93.45 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.883 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -29.09 24.43 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.427 HG23 HG12 ' B' ' 686' ' ' ILE . 1.0 OUTLIER -58.36 -43.34 86.16 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 C-N-CA 120.492 -0.483 . . . . 0.0 110.191 -179.082 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 46.7 mt -58.68 -41.45 82.35 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.705 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.259 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 42.5 mm -56.28 -41.31 70.28 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 689' ' ' VAL . 46.3 t -68.09 -0.27 1.13 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 120.531 -0.467 . . . . 0.0 111.411 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -99.24 -31.94 5.99 Favored Glycine 0 CA--C 1.535 1.329 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.1 m -73.72 -16.86 61.18 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.853 0.327 . . . . 0.0 111.232 179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.0 -40.14 80.02 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.224 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.703 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.2 OUTLIER -70.61 -35.42 61.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 C-N-CA 120.123 -0.631 . . . . 0.0 110.368 179.668 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.67 -47.78 83.51 Favored Glycine 0 C--N 1.347 1.159 0 N-CA-C 109.897 -1.281 . . . . 0.0 109.897 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.632 ' O ' HD23 ' A' ' 695' ' ' LEU . 4.6 tt -56.13 -31.68 63.55 Favored 'General case' 0 C--O 1.21 -1.013 0 CA-C-O 121.032 0.444 . . . . 0.0 110.793 179.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -50.52 -34.82 26.77 Favored 'General case' 0 C--O 1.213 -0.82 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 7.5 tp -58.04 -40.07 75.22 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 -175.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.576 HG22 ' O ' ' A' ' 695' ' ' LEU . 17.4 m -55.27 -28.04 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 CA-C-N 118.807 0.73 . . . . 0.0 110.696 -178.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -55.76 -36.38 67.26 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.43 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -59.66 -50.51 73.58 Favored 'General case' 0 C--O 1.219 -0.536 0 O-C-N 123.291 0.369 . . . . 0.0 111.064 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 698' ' ' VAL . 9.0 p -68.16 -33.99 63.93 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 120.491 -0.484 . . . . 0.0 109.939 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . 0.79 ' O ' HG12 ' A' ' 705' ' ' VAL . 0.3 OUTLIER -66.58 -36.99 83.99 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 178.814 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . 0.448 ' N ' HD23 ' A' ' 702' ' ' LEU . 66.8 m -64.4 -43.93 92.9 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.394 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 11.4 tp -81.01 -17.46 50.23 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.79 HG12 ' O ' ' A' ' 702' ' ' LEU . 2.5 p -60.89 -29.24 45.02 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.226 -178.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -61.91 -11.12 11.48 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 52.5 ttt85 -73.68 -35.3 65.18 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 121.112 -0.235 . . . . 0.0 110.795 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 47.3 t -102.44 -36.19 4.33 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.531 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.18 -179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -162.39 154.7 19.14 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.899 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.105 -0.95 . . . . 0.0 110.83 179.972 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.478 HD22 ' HB2' ' A' ' 667' ' ' ALA . 12.5 tp . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 55.0 mt -135.93 149.49 48.95 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.358 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -178.6 174.47 1.2 Allowed 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.61 HD12 ' N ' ' B' ' 664' ' ' ASP . 0.3 OUTLIER -58.3 -15.07 8.86 Favored 'General case' 0 C--O 1.211 -0.967 0 C-N-CA 119.041 -1.063 . . . . 0.0 111.06 179.757 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . 0.61 ' N ' HD12 ' B' ' 663' ' ' LEU . 4.0 p-10 -66.25 -39.72 89.68 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 9.8 tptt -70.67 -46.42 63.22 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.743 179.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . 0.515 ' CD1' HD12 ' C' ' 661' ' ' LEU . 77.0 m95 -73.19 -30.64 63.69 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -81.52 -10.74 59.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.542 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 5.7 t -75.23 -32.58 61.17 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 121.147 -0.221 . . . . 0.0 110.86 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' B' ' 666' ' ' TRP . 0.0 OUTLIER -65.29 -12.61 53.44 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 119.973 -0.691 . . . . 0.0 110.686 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 14.1 m95 -68.22 -19.41 64.74 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 119.804 -0.758 . . . . 0.0 110.112 179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -89.46 -47.95 7.65 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . 0.429 ' CH2' HD22 ' B' ' 669' ' ' LEU . 6.1 p-90 -103.16 -23.51 13.64 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 113.596 0.961 . . . . 0.0 113.596 -177.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 51.15 -3.45 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 116.228 1.936 . . . . 0.0 116.228 177.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.24 -53.27 55.69 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 120.217 1.371 . . . . 0.0 113.68 -177.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.32 -27.93 38.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 119.639 -0.825 . . . . 0.0 110.755 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 2.3 m -59.11 -50.06 75.49 Favored 'General case' 0 C--O 1.216 -0.679 0 C-N-CA 120.674 -0.41 . . . . 0.0 111.105 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -69.03 -20.95 64.14 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.542 -179.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 8.2 t90 -72.19 -46.86 54.55 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 4.2 mp -94.43 -10.45 32.42 Favored 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 2.2 t90 -92.55 -15.44 26.97 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 119.886 -0.725 . . . . 0.0 112.226 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 75.8 m-85 -114.04 -31.53 6.33 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.43 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 23.8 mm -65.59 -44.66 93.73 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 CA-C-O 119.24 -0.41 . . . . 0.0 111.48 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.96 -42.7 76.63 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 119.663 -0.815 . . . . 0.0 111.172 -178.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 84.4 mt -68.7 -41.96 82.84 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 178.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.409 ' HA ' HD13 ' B' ' 688' ' ' ILE . 10.9 t80 -52.79 -28.86 24.38 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.024 -178.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.686 HG21 HD12 ' C' ' 686' ' ' ILE . 1.4 mp -58.73 -37.61 67.02 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.5 mt -58.54 -41.87 83.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.536 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 179.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . 0.513 HD12 ' N ' ' B' ' 688' ' ' ILE . 2.7 mp -62.34 -41.28 91.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.586 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.451 ' O ' HG12 ' B' ' 689' ' ' VAL . 47.2 t -67.86 -4.14 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 120.302 -0.559 . . . . 0.0 111.305 -179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.46 -45.11 7.06 Favored Glycine 0 C--N 1.348 1.24 0 N-CA-C 109.561 -1.416 . . . . 0.0 109.561 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 2.5 m -69.76 -22.9 63.31 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 121.128 -0.229 . . . . 0.0 110.856 178.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -54.34 -32.94 57.9 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.964 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 1.9 pp -65.2 -38.21 82.08 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.808 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . 0.687 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -64.58 -51.73 49.43 Favored Glycine 0 C--O 1.213 -1.172 0 N-CA-C 111.15 -0.78 . . . . 0.0 111.15 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.428 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.4 OUTLIER -56.72 -42.25 78.87 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.366 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.85 -30.27 13.99 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.687 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.6 tp -58.63 -40.54 79.5 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -175.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.428 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.9 p -55.88 -28.03 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 118.306 0.503 . . . . 0.0 111.773 -178.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -55.29 -26.98 43.71 Favored 'General case' 0 C--O 1.215 -0.745 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.275 -179.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.77 -35.61 63.97 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.563 -0.455 . . . . 0.0 110.145 178.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 64.8 t -59.86 -32.73 50.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.926 -179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 1.1 pp -61.44 -30.79 70.8 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 120.386 -0.526 . . . . 0.0 111.296 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.6 t -58.1 -36.19 72.51 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.988 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . 0.492 ' O ' HG12 ' B' ' 708' ' ' VAL . 18.0 tp -63.93 -32.39 73.9 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 120.398 -0.521 . . . . 0.0 110.235 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 21.4 t -83.08 -33.71 10.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 120.969 -0.293 . . . . 0.0 110.375 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -65.28 -34.32 78.07 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 121.159 -0.216 . . . . 0.0 111.579 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -74.57 -33.54 62.7 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.56 -179.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.51 ' O ' HG22 ' B' ' 708' ' ' VAL . 9.9 p -111.11 26.11 3.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.292 -179.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -49.35 111.21 0.46 Allowed 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.95 -0.3 . . . . 0.0 111.226 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.346 -0.835 . . . . 0.0 110.976 -179.888 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.515 HD12 ' CD1' ' B' ' 666' ' ' TRP . 3.4 mt -73.45 -172.01 1.1 Allowed 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -144.89 106.93 4.3 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 11.7 mt -58.07 -33.12 68.71 Favored 'General case' 0 C--O 1.22 -0.489 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.359 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -60.55 -23.9 64.98 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.658 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . 0.446 ' CE ' HG21 ' C' ' 675' ' ' ILE . 7.7 tmtt? -70.13 -41.68 73.6 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.15 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . 0.79 ' O ' HD12 ' C' ' 669' ' ' LEU . 76.2 m95 -73.05 -33.89 65.95 Favored 'General case' 0 C--O 1.214 -0.803 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.041 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -83.2 -30.75 27.51 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 120.414 -0.514 . . . . 0.0 111.013 -179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 3.3 p -56.23 -30.92 63.0 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.869 -0.332 . . . . 0.0 110.6 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.79 HD12 ' O ' ' C' ' 666' ' ' TRP . 0.0 OUTLIER -55.37 -10.97 0.69 Allowed 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -177.78 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . 0.762 ' N ' HD13 ' C' ' 669' ' ' LEU . 20.6 m95 -68.19 -31.1 70.39 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 119.451 -0.9 . . . . 0.0 109.915 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 27.1 m120 -83.29 -50.0 8.83 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 119.642 -0.823 . . . . 0.0 112.791 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . 0.533 ' CZ3' HG22 ' C' ' 675' ' ' ILE . 4.8 p-90 -97.94 -23.53 15.78 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 116.296 1.961 . . . . 0.0 116.296 -178.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 54.89 -7.38 0.02 OUTLIER 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 121.453 1.933 . . . . 0.0 115.758 177.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -63.47 -53.06 58.04 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.533 HG22 ' CZ3' ' C' ' 672' ' ' TRP . 0.4 OUTLIER -69.08 -40.03 80.23 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 C-N-CA 118.88 -1.128 . . . . 0.0 112.617 -178.199 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . 0.524 ' HB ' HD23 ' C' ' 669' ' ' LEU . 77.2 m -63.61 -33.78 76.37 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.926 -179.015 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -64.79 -47.09 79.36 Favored 'General case' 0 C--O 1.21 -0.995 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.113 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.487 ' O ' HG23 ' C' ' 682' ' ' ILE . 2.5 t90 -72.31 -45.99 57.61 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.154 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.554 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.2 OUTLIER -71.57 -32.86 68.54 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.735 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -110.37 62.29 0.6 Allowed 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -173.92 -33.99 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.231 178.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.487 HG23 ' O ' ' C' ' 678' ' ' TRP . 16.3 pt -55.19 -36.89 41.39 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.723 0 CA-C-O 119.324 -0.369 . . . . 0.0 111.88 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 10.9 mtp180 -56.69 -48.32 77.93 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.434 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 81.1 mt -67.56 -44.48 86.39 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.562 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.291 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.484 ' HA ' HD12 ' C' ' 688' ' ' ILE . 4.7 m-85 -53.06 -28.45 24.81 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.907 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.686 HD12 HG21 ' B' ' 686' ' ' ILE . 14.8 mm -58.29 -40.11 76.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 120.023 -0.671 . . . . 0.0 110.098 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.5 mt -59.78 -42.11 87.76 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.601 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.484 HD12 ' HA ' ' C' ' 685' ' ' PHE . 66.6 mt -65.1 -41.44 91.86 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.129 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.617 ' O ' HD12 ' C' ' 692' ' ' LEU . 96.2 t -67.48 -22.34 28.61 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.171 0 CA-C-O 118.527 -0.749 . . . . 0.0 112.872 -176.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.01 -4.13 90.36 Favored Glycine 0 CA--C 1.55 2.251 0 CA-C-N 119.668 1.122 . . . . 0.0 113.665 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 43.3 m -88.82 -34.7 16.95 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.76 1.28 . . . . 0.0 113.223 -178.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . 0.898 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -64.79 -31.75 73.12 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.073 -178.775 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.898 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.0 OUTLIER -69.03 -29.17 42.23 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 179.268 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.69 -40.85 95.38 Favored Glycine 0 CA--C 1.541 1.707 0 C-N-CA 120.193 -1.003 . . . . 0.0 110.97 179.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.507 ' O ' HD23 ' C' ' 695' ' ' LEU . 1.3 tt -56.8 -34.08 67.31 Favored 'General case' 0 CA--C 1.553 1.094 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.27 -34.83 24.65 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.699 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.2 OUTLIER -58.27 -40.69 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 N-CA-C 112.99 0.737 . . . . 0.0 112.99 -175.469 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.404 HG12 ' O ' ' C' ' 695' ' ' LEU . 8.2 p -56.02 -28.93 25.74 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.924 0 CA-C-N 119.187 0.903 . . . . 0.0 111.064 -178.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . 0.439 ' O ' HD23 ' C' ' 702' ' ' LEU . 0.1 OUTLIER -57.6 -35.45 70.45 Favored 'General case' 0 C--O 1.216 -0.662 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.759 -179.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.7 -35.62 66.26 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 112.232 0.456 . . . . 0.0 112.232 -177.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.84 -31.47 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.799 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . 0.439 HD23 ' O ' ' C' ' 699' ' ' PHE . 1.4 pp -58.54 -25.52 62.56 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 119.891 -0.724 . . . . 0.0 110.943 -179.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 74.2 m -57.85 -38.35 75.52 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 120.609 -0.437 . . . . 0.0 110.332 179.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . 0.574 ' O ' HD13 ' C' ' 704' ' ' LEU . 0.5 OUTLIER -60.15 -39.14 85.31 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 178.355 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.8 t -69.91 -18.82 22.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.868 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -60.67 -16.65 41.36 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -178.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . 0.539 ' HG3' HG23 ' C' ' 708' ' ' VAL . 13.7 ptm180 -73.87 -37.57 64.7 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.484 -0.487 . . . . 0.0 110.703 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . 0.539 HG23 ' HG3' ' C' ' 707' ' ' ARG . 21.0 t -96.46 9.5 6.17 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.801 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 15.2 tpp85 63.44 138.77 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 O-C-N 122.267 -0.271 . . . . 0.0 110.874 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 . . . . . 0 C--O 1.219 -0.548 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.538 179.804 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.654 ' CG ' HD23 ' C' ' 663' ' ' LEU . 10.1 tt . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.623 HD23 ' CE2' ' A' ' 666' ' ' TRP . 1.5 tp -150.72 -54.72 0.15 Allowed 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.393 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 48.42 177.39 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 114.61 1.337 . . . . 0.0 114.61 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.529 HD12 ' HB2' ' B' ' 660' ' ' LEU . 8.1 tt -52.33 -38.59 58.99 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 114.254 -1.339 . . . . 0.0 111.588 -178.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 93.8 m-20 -60.97 -41.81 97.09 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -177.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . 0.417 ' HG3' ' HA ' ' A' ' 661' ' ' LEU . 23.7 mmtp -71.11 -44.51 65.5 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 118.869 -1.133 . . . . 0.0 112.497 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . 0.623 ' CE2' HD23 ' A' ' 661' ' ' LEU . 85.5 m95 -59.04 -39.2 81.26 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 120.321 -0.552 . . . . 0.0 110.955 -179.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.23 -39.65 94.4 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 120.095 -0.642 . . . . 0.0 111.238 -179.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 32.2 t -58.11 -32.68 68.34 Favored 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.557 179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.505 HD22 ' OG1' ' A' ' 676' ' ' THR . 0.4 OUTLIER -69.7 -7.76 42.06 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.43 179.812 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 33.8 m0 -75.28 -6.75 51.44 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -62.57 -48.96 77.17 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 119.721 -0.792 . . . . 0.0 111.283 -179.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.72 -22.53 13.54 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 19.1 p90 49.67 -3.07 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -63.71 -53.55 49.38 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-N 120.355 1.434 . . . . 0.0 110.165 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . . . . . . . . . 14.6 mm -69.43 -27.84 35.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.469 178.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . 0.505 ' OG1' HD22 ' A' ' 669' ' ' LEU . 32.9 m -58.92 -48.63 80.79 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -64.92 -34.84 79.37 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 177.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.456 ' O ' HG23 ' A' ' 682' ' ' ILE . 28.5 t90 -64.38 -19.91 65.79 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.765 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -84.96 -2.68 58.2 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 120.297 -0.561 . . . . 0.0 112.195 -179.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 53.9 t-105 -145.16 -43.93 0.23 Allowed 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 120.123 -0.631 . . . . 0.0 112.108 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -66.22 -13.08 59.76 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.456 HG23 ' O ' ' A' ' 678' ' ' TRP . 13.7 pt -55.33 -36.15 39.39 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.721 0 C-N-CA 120.536 -0.465 . . . . 0.0 110.935 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.54 ' NH2' HD22 ' B' ' 679' ' ' LEU . 26.0 ttp180 -54.86 -32.77 61.08 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.894 -179.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 45.2 mm -59.69 -48.28 88.07 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.066 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -67.82 -28.2 67.37 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 113.364 0.876 . . . . 0.0 113.364 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.543 HD12 HG21 ' C' ' 686' ' ' ILE . 29.2 mm -58.12 -43.16 84.82 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.451 0.569 . . . . 0.0 111.853 -177.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 63.4 mt -58.29 -41.88 82.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 119.84 -0.744 . . . . 0.0 110.024 -179.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 47.5 mt -62.83 -41.49 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 110.392 -0.225 . . . . 0.0 110.392 179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.619 ' O ' HD11 ' A' ' 692' ' ' LEU . 60.5 t -68.21 -3.96 2.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -177.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -101.5 6.21 55.26 Favored Glycine 0 CA--C 1.543 1.794 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.846 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 14.6 m -88.31 -34.23 17.73 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 117.4 0.6 . . . . 0.0 111.781 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.619 HD11 ' O ' ' A' ' 689' ' ' VAL . 0.2 OUTLIER -54.0 -32.64 54.76 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.488 -178.496 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.718 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.2 OUTLIER -61.75 -37.9 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.529 -179.013 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.82 -36.82 74.91 Favored Glycine 0 C--O 1.212 -1.219 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.76 -36.44 69.79 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.53 ' HG3' HD11 ' C' ' 693' ' ' ILE . 86.6 mmt-85 -52.76 -35.94 57.15 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -178.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . 0.433 HD12 ' N ' ' A' ' 698' ' ' VAL . 2.3 pp -59.15 -41.82 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.688 ' O ' HG12 ' A' ' 701' ' ' VAL . 9.2 p -64.88 -29.57 47.79 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.815 0 C-N-CA 118.889 -1.124 . . . . 0.0 111.272 -178.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -55.8 -35.57 66.46 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 121.129 -0.228 . . . . 0.0 110.897 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.91 -35.6 66.77 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.978 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.688 HG12 ' O ' ' A' ' 698' ' ' VAL . 1.7 p -59.91 -33.11 51.56 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.914 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 1.6 tt -65.86 -29.84 70.35 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.182 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 42.3 p -57.59 -47.42 82.15 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.698 -179.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 11.6 tp -63.52 -39.39 94.31 Favored 'General case' 0 C--O 1.215 -0.719 0 CA-C-N 116.34 -0.391 . . . . 0.0 109.95 179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 73.8 t -60.85 -15.38 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.154 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -80.23 -12.63 59.61 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -73.82 -27.79 61.3 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 120.091 -0.644 . . . . 0.0 111.579 -179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 39.1 t -82.81 -36.08 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.438 -179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.94 179.14 5.05 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.602 -0.439 . . . . 0.0 110.396 -179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.848 -179.936 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.529 ' HB2' HD12 ' A' ' 663' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.427 HD12 ' CZ2' ' B' ' 666' ' ' TRP . 4.5 mm? -108.3 119.18 38.75 Favored 'General case' 0 C--O 1.219 -0.542 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.936 179.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -137.98 162.08 35.02 Favored 'General case' 0 C--O 1.217 -0.623 0 C-N-CA 120.435 -0.506 . . . . 0.0 111.381 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.452 ' C ' HD23 ' B' ' 663' ' ' LEU . 10.6 tt -59.18 -40.17 84.84 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.932 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 58.5 m-20 -73.79 -25.32 60.07 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.913 -179.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -68.82 -46.15 69.36 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.783 -179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . 0.427 ' CZ2' HD12 ' B' ' 661' ' ' LEU . 95.6 m95 -64.52 -53.58 45.79 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 120.834 -0.347 . . . . 0.0 110.856 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . 0.5 ' HB2' HD13 ' C' ' 660' ' ' LEU . . . -58.48 -23.13 56.99 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 120.685 -0.406 . . . . 0.0 111.116 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.92 -33.29 70.39 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.877 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 68.9 mt -65.03 -17.52 64.52 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 15.7 m95 -68.51 -2.9 9.79 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 120.612 -0.435 . . . . 0.0 112.002 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -73.32 -48.61 32.98 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.231 -0.588 . . . . 0.0 112.2 -178.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.88 -23.17 13.4 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 120.124 -0.63 . . . . 0.0 111.82 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 42.8 t80 58.92 -12.25 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.112 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -63.55 -52.56 60.58 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 119.345 0.975 . . . . 0.0 111.636 -179.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.496 HD11 HD23 ' B' ' 679' ' ' LEU . 6.6 tp -68.46 -27.77 37.84 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.971 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.613 179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 25.8 m -58.41 -41.77 85.71 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.405 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.75 -45.56 92.15 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.451 -0.5 . . . . 0.0 110.827 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 10.4 t90 -72.14 -37.3 69.47 Favored 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.064 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.54 HD22 ' NH2' ' A' ' 683' ' ' ARG . 0.2 OUTLIER -78.66 -3.09 42.31 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -178.149 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -120.37 -35.2 3.47 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 120.138 -0.625 . . . . 0.0 112.115 -178.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -66.52 -7.69 21.65 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.295 -0.562 . . . . 0.0 112.156 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.546 ' O ' HD13 ' B' ' 686' ' ' ILE . 0.2 OUTLIER -67.8 -46.27 82.72 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 119.926 -0.71 . . . . 0.0 112.535 -179.326 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 37.3 ptt180 -62.96 -42.8 99.93 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 118.58 0.627 . . . . 0.0 111.654 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 94.7 mt -65.7 -43.98 93.5 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -57.27 -34.18 68.39 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 120.766 -0.374 . . . . 0.0 110.22 178.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.905 HG21 HD11 ' C' ' 686' ' ' ILE . 1.1 mp -58.72 -46.14 90.73 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 62.7 mt -58.65 -41.6 82.66 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.548 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 15.6 mm -59.64 -42.92 89.99 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.547 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 75.3 t -68.38 -15.74 20.09 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 CA-C-O 119.277 -0.392 . . . . 0.0 111.885 -179.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -71.27 -54.18 9.36 Favored Glycine 0 C--N 1.347 1.185 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 44.1 m -64.44 -23.22 67.21 Favored 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 120.925 -0.31 . . . . 0.0 111.291 179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.4 tp -53.99 -32.77 55.09 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.565 -178.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . . . . . . . . . 2.4 pp -65.3 -39.37 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.275 -0.57 . . . . 0.0 111.097 -178.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.18 -48.06 78.71 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.098 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.406 ' O ' HG12 ' B' ' 698' ' ' VAL . 1.1 mt -56.83 -42.25 79.29 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 117.153 0.477 . . . . 0.0 111.9 -178.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.48 -29.92 11.57 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -179.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.743 HD11 ' HD3' ' C' ' 696' ' ' ARG . 41.7 mm -58.44 -40.57 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.0 0 CA-C-O 119.023 -0.513 . . . . 0.0 111.679 -176.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.406 HG12 ' O ' ' B' ' 695' ' ' LEU . 5.4 p -55.76 -28.16 23.27 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 CA-C-N 118.652 0.66 . . . . 0.0 111.296 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -55.35 -26.84 43.37 Favored 'General case' 0 C--O 1.218 -0.584 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.346 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -52.56 -35.66 54.23 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 120.541 -0.463 . . . . 0.0 110.006 178.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 60.7 t -59.99 -34.92 58.06 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.219 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.33 -35.23 73.44 Favored 'General case' 0 C--O 1.219 -0.522 0 O-C-N 123.007 0.192 . . . . 0.0 110.608 179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 2.6 t -57.98 -31.85 67.31 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.667 -0.413 . . . . 0.0 110.855 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 6.9 tp -60.65 -42.5 97.11 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 179.335 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 61.1 t -73.69 -19.82 17.91 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.977 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -64.44 -8.63 14.2 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 28.2 mtt180 -73.96 -40.95 62.66 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.175 -179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 34.9 t -87.52 -36.19 9.34 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.784 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 26.9 ttp180 -122.26 145.32 48.34 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.138 -179.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 . . . . . 0 C--O 1.221 -0.424 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.683 -179.925 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' B' ' 667' ' ' ALA . 58.1 mt . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 2.1 tp -45.77 142.07 2.67 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 111.45 0.167 . . . . 0.0 111.45 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . 0.434 ' HG3' HD12 ' B' ' 663' ' ' LEU . 2.0 mt-10 -169.7 165.69 9.97 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.197 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.691 HD13 ' H ' ' C' ' 664' ' ' ASP . 0.0 OUTLIER -58.09 -31.12 66.8 Favored 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.509 -179.416 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . 0.691 ' H ' HD13 ' C' ' 663' ' ' LEU . 6.2 t70 -74.22 -27.43 60.79 Favored 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 112.074 0.398 . . . . 0.0 112.074 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.6 mmtm -63.28 -42.31 99.08 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.321 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -58.74 -31.41 68.29 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.55 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.89 -16.17 6.25 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 120.414 -0.514 . . . . 0.0 110.513 178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 17.6 m -53.23 -32.96 50.86 Favored 'General case' 0 C--O 1.218 -0.561 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.45 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' C' ' 673' ' ' PHE . 11.9 tp -55.83 -13.44 1.78 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.841 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 16.9 m95 -69.59 -43.44 72.79 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -177.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -88.78 -52.01 5.35 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 117.25 -1.78 . . . . 0.0 113.67 -177.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . 0.511 ' HE1' ' C18' ' C' ' 801' ' ' QOJ 0.258 6.0 p-90 -103.96 -21.96 13.55 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 178.142 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . 0.437 ' HA ' HD12 ' C' ' 669' ' ' LEU . 2.2 t80 72.53 -27.77 0.19 Allowed 'General case' 0 C--N 1.373 1.622 0 N-CA-C 116.747 2.129 . . . . 0.0 116.747 175.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . 0.425 ' HB2' ' CE3' ' C' ' 672' ' ' TRP . 0.1 OUTLIER -64.26 -53.08 54.65 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 116.874 2.176 . . . . 0.0 116.874 -175.419 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 10.9 tp -69.76 -48.8 62.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 CA-C-N 120.946 1.703 . . . . 0.0 115.25 -176.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . 0.404 ' HB ' ' CD1' ' C' ' 669' ' ' LEU . 19.8 m -61.27 -33.88 74.26 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 118.973 -1.091 . . . . 0.0 109.123 -178.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -62.84 -17.5 61.46 Favored 'General case' 0 C--O 1.216 -0.698 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.082 177.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.406 ' O ' HD13 ' C' ' 682' ' ' ILE . 19.6 t90 -71.89 -44.66 63.37 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -178.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.501 ' N ' HD12 ' C' ' 679' ' ' LEU . 7.5 mp -67.93 -2.77 8.07 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 120.321 -0.552 . . . . 0.0 111.596 -178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.35 168.85 18.16 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 178.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 78.49 -39.05 0.25 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.541 0.736 . . . . 0.0 110.711 -178.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.406 HD13 ' O ' ' C' ' 678' ' ' TRP . 1.7 mp -58.77 -36.8 62.54 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 178.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 6.0 ptt-85 -55.83 -44.47 77.96 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.061 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 44.3 mt -68.33 -36.81 76.51 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.347 178.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -52.01 -30.21 24.3 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 112.538 0.57 . . . . 0.0 112.538 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.905 HD11 HG21 ' B' ' 686' ' ' ILE . 1.8 mp -64.07 -42.98 97.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 65.6 mt -58.84 -41.22 82.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.536 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 46.5 mm -56.8 -41.86 76.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.495 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 57.4 t -67.81 -31.51 52.55 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 119.904 -0.719 . . . . 0.0 111.358 -178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . 0.448 ' O ' HG22 ' C' ' 693' ' ' ILE . . . -55.09 -47.68 72.18 Favored Glycine 0 C--N 1.353 1.506 0 N-CA-C 109.941 -1.264 . . . . 0.0 109.941 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.6 -33.98 76.88 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.831 -0.347 . . . . 0.0 110.169 178.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.2 tp -62.04 -57.06 13.05 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.612 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.771 ' O ' HD13 ' C' ' 693' ' ' ILE . 0.1 OUTLIER -55.96 -29.07 25.73 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.748 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.128 179.614 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.24 -41.09 94.7 Favored Glycine 0 CA--C 1.541 1.695 0 N-CA-C 110.932 -0.867 . . . . 0.0 110.932 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.667 ' O ' HG22 ' C' ' 698' ' ' VAL . 0.9 OUTLIER -56.54 -31.22 63.95 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 117.369 0.584 . . . . 0.0 111.223 179.396 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.743 ' HD3' HD11 ' B' ' 697' ' ' ILE . 1.5 mmt180 -49.78 -35.24 21.86 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 6.9 tp -58.68 -40.92 80.84 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.985 0 N-CA-C 114.025 1.12 . . . . 0.0 114.025 -175.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.667 HG22 ' O ' ' C' ' 695' ' ' LEU . 16.4 m -55.91 -28.5 24.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 CA-C-N 119.305 0.957 . . . . 0.0 111.31 -178.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -55.63 -35.5 65.98 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 120.881 -0.328 . . . . 0.0 111.299 179.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.81 -39.02 70.76 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.015 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 75.2 t -68.05 -39.79 82.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.514 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 10.1 tt -58.92 -28.8 66.57 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.512 179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 23.4 p -59.92 -35.52 75.06 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.652 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.2 tp -59.11 -40.62 85.91 Favored 'General case' 0 C--O 1.216 -0.674 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 20.1 t -66.29 -19.8 26.23 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.594 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -60.76 -10.91 6.12 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 23.0 ptt85 -101.02 -12.76 18.62 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 112.092 0.404 . . . . 0.0 112.092 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 55.9 t -82.86 -30.86 8.79 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.226 -178.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 83.4 mtm-85 -54.37 124.99 17.68 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.406 -0.518 . . . . 0.0 111.27 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 . . . . . 0 C--O 1.219 -0.508 0 CA-C-O 117.912 -1.042 . . . . 0.0 110.811 179.844 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . 0.511 ' C18' ' HE1' ' C' ' 672' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 4.7 mp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.46 HD22 ' CD1' ' C' ' 666' ' ' TRP . 5.4 tp -67.11 -146.74 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -169.34 96.34 0.33 Allowed 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 118.367 0.53 . . . . 0.0 110.919 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.515 ' C ' HD23 ' A' ' 663' ' ' LEU . 9.9 tt -67.08 -40.43 87.01 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-O 120.929 0.395 . . . . 0.0 111.368 -179.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -68.21 -23.5 64.83 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.248 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 13.9 tmtt? -67.26 -34.6 77.77 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 120.509 -0.477 . . . . 0.0 110.709 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -61.08 -35.74 77.79 Favored 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.512 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . 0.401 ' HB2' HD22 ' B' ' 660' ' ' LEU . . . -92.37 -19.26 22.28 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.97 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 75.5 m -73.91 -37.34 64.68 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.044 178.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.531 ' C ' HD12 ' A' ' 669' ' ' LEU . 4.4 pp -63.48 -9.06 11.05 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.311 -0.556 . . . . 0.0 111.889 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 7.8 m95 -68.34 -19.73 64.67 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.219 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -84.67 -48.13 9.78 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -178.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 4.5 p90 -100.95 -22.74 14.7 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 118.082 0.401 . . . . 0.0 111.967 -178.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 48.58 16.64 0.11 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -63.4 -54.03 43.13 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.18 -177.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.626 HD12 HD12 ' A' ' 679' ' ' LEU . 0.3 OUTLIER -69.77 -31.32 47.96 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 C-N-CA 119.699 -0.8 . . . . 0.0 110.704 178.291 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 13.8 m -58.26 -33.84 69.84 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.459 -178.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -59.69 -44.05 93.8 Favored 'General case' 0 C--O 1.215 -0.753 0 C-N-CA 119.817 -0.753 . . . . 0.0 108.973 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -72.82 -46.09 54.94 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.451 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.626 HD12 HD12 ' A' ' 675' ' ' ILE . 14.1 mt -67.57 -2.87 7.34 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -177.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.7 m95 -133.23 142.51 48.6 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 92.12 -32.51 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.232 1.013 . . . . 0.0 111.277 -179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.613 HD12 ' N ' ' A' ' 683' ' ' ARG . 2.7 pp -68.09 -41.23 84.13 Favored 'Isoleucine or valine' 0 C--N 1.35 0.624 0 C-N-CA 119.315 -0.954 . . . . 0.0 109.55 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.613 ' N ' HD12 ' A' ' 682' ' ' ILE . 54.3 ttp180 -69.28 -47.08 65.62 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.9 mp -59.98 -37.43 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.734 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -52.19 -43.72 64.34 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 120.574 -0.45 . . . . 0.0 110.865 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.484 HG12 HG22 ' C' ' 686' ' ' ILE . 1.9 mp -58.73 -37.91 68.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 119.898 -0.721 . . . . 0.0 109.753 179.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 39.6 mm -58.04 -42.13 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 178.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 80.2 mt -59.86 -41.19 84.94 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 176.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.664 HG13 HG21 ' C' ' 693' ' ' ILE . 57.2 t -67.51 -25.41 33.15 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.593 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -61.76 -32.28 81.12 Favored Glycine 0 C--N 1.35 1.336 0 N-CA-C 110.055 -1.218 . . . . 0.0 110.055 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.9 m -86.16 -31.82 21.59 Favored 'General case' 0 C--O 1.219 -0.529 0 N-CA-C 110.319 -0.252 . . . . 0.0 110.319 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.418 HD23 HD12 ' C' ' 693' ' ' ILE . 5.2 tp -59.69 -44.63 93.58 Favored 'General case' 0 C--O 1.218 -0.579 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.009 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.555 HD11 ' CG ' ' B' ' 696' ' ' ARG . 4.1 tp -55.58 -35.85 39.88 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.988 -179.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -72.61 -40.11 54.44 Favored Glycine 0 C--O 1.215 -1.078 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.799 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.8 OUTLIER -56.8 -40.21 75.51 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 120.861 0.362 . . . . 0.0 110.886 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.747 ' HG3' HD11 ' C' ' 693' ' ' ILE . 40.4 mmt180 -53.31 -35.21 59.91 Favored 'General case' 0 C--O 1.214 -0.789 0 N-CA-C 114.149 1.166 . . . . 0.0 114.149 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . 0.672 HD13 ' O ' ' A' ' 697' ' ' ILE . 0.2 OUTLIER -58.27 -40.69 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 120.451 -0.499 . . . . 0.0 112.008 -176.019 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.799 HG12 ' O ' ' A' ' 695' ' ' LEU . 12.4 p -55.96 -28.26 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.775 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.021 -179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -55.41 -35.88 65.85 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.602 179.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.02 -35.71 67.15 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.435 -0.506 . . . . 0.0 109.763 179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 92.6 t -65.77 -34.36 69.8 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.765 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 9.0 tp -60.28 -29.84 69.08 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 116.587 -0.279 . . . . 0.0 110.915 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 26.8 m -57.95 -45.52 86.51 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.657 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 15.0 tp -64.88 -39.99 94.42 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 178.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 78.0 t -69.73 -24.94 27.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.56 179.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 32.6 t30 -71.0 -31.38 67.89 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.402 ' HG3' HG13 ' A' ' 708' ' ' VAL . 0.1 OUTLIER -74.38 -23.11 58.94 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 120.162 -0.615 . . . . 0.0 111.843 -179.172 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.402 HG13 ' HG3' ' A' ' 707' ' ' ARG . 33.9 m -99.36 25.97 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.642 0 C-N-CA 120.534 -0.467 . . . . 0.0 111.259 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -51.09 70.85 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.357 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.83 179.741 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.401 HD22 ' HB2' ' A' ' 667' ' ' ALA . 9.8 tp . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 60.3 mt 61.13 123.61 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.344 0.403 . . . . 0.0 111.091 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -158.32 176.94 11.82 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.99 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.74 -39.52 88.99 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.486 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.09 -28.23 64.18 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.693 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -69.95 -46.02 66.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.741 -179.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -70.14 -37.58 75.29 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.967 -0.293 . . . . 0.0 111.591 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -68.32 -41.96 80.07 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -178.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 3.0 p -54.48 -31.5 55.93 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.475 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.851 HD21 HG23 ' B' ' 675' ' ' ILE . 13.0 tp -61.84 -10.5 9.33 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.918 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . 0.416 ' HZ2' HD13 ' C' ' 660' ' ' LEU . 37.8 m0 -68.4 -25.51 65.08 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 119.885 -0.726 . . . . 0.0 111.112 179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 52.2 m-80 -62.98 -46.29 88.41 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -178.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.19 -23.91 13.6 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 120.009 -0.676 . . . . 0.0 111.447 -179.115 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 72.7 t80 45.56 10.47 0.01 OUTLIER 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 176.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 16.1 t0 -64.13 -54.7 29.66 Favored 'General case' 0 C--N 1.354 0.782 0 CA-C-N 119.74 1.155 . . . . 0.0 113.356 -177.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.851 HG23 HD21 ' B' ' 669' ' ' LEU . 9.2 tp -69.98 -27.58 33.27 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.914 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.838 178.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 9.4 m -58.71 -45.9 88.52 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.898 -178.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -61.81 -47.19 86.24 Favored 'General case' 0 C--O 1.215 -0.762 0 C-N-CA 120.264 -0.575 . . . . 0.0 111.557 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.403 ' CE3' HD12 ' B' ' 675' ' ' ILE . 3.6 t90 -72.21 -42.04 66.21 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 7.9 tp -74.25 -33.01 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -177.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -96.28 23.95 6.19 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 120.204 -0.599 . . . . 0.0 112.326 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -137.9 11.47 2.88 Favored 'General case' 0 C--O 1.218 -0.583 0 C-N-CA 120.396 -0.521 . . . . 0.0 111.549 178.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.433 HD13 ' HD2' ' A' ' 683' ' ' ARG . 16.8 pt -65.05 -43.3 95.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 87.9 mtm-85 -59.69 -46.18 89.85 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.105 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.487 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.0 mp -68.33 -39.22 80.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.8 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.132 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -62.27 -51.16 68.82 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.521 HG21 HD12 ' C' ' 686' ' ' ILE . 2.6 mp -65.14 -39.82 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 C-N-CA 120.316 -0.553 . . . . 0.0 111.491 -178.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 80.4 mt -58.75 -41.71 83.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 119.593 -0.843 . . . . 0.0 108.855 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 55.3 mt -58.54 -41.63 82.41 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 61.2 t -67.79 -29.4 44.93 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.878 -179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -58.92 -43.33 96.82 Favored Glycine 0 C--N 1.35 1.351 0 N-CA-C 109.437 -1.465 . . . . 0.0 109.437 178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.49 -34.09 73.81 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 178.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 3.7 tp -63.53 -43.38 97.3 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.944 -179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.49 HG12 HD13 ' A' ' 693' ' ' ILE . 0.4 OUTLIER -66.13 -39.1 83.48 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 120.623 -0.431 . . . . 0.0 110.822 -179.138 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.81 -42.09 87.28 Favored Glycine 0 CA--C 1.531 1.045 0 N-CA-C 109.827 -1.309 . . . . 0.0 109.827 179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 1.7 tt -56.15 -31.44 63.35 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-O 120.743 0.306 . . . . 0.0 110.31 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.555 ' CG ' HD11 ' A' ' 693' ' ' ILE . 2.0 tpm_? -50.71 -31.9 17.88 Favored 'General case' 0 C--O 1.216 -0.69 0 C-N-CA 122.814 0.446 . . . . 0.0 111.896 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 45.5 mt -60.17 -42.87 91.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 C-N-CA 120.591 -0.444 . . . . 0.0 111.356 -177.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.524 ' O ' HG22 ' B' ' 701' ' ' VAL . 44.2 t -57.0 -28.94 30.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 120.831 -0.348 . . . . 0.0 111.517 -178.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.7 -25.41 39.91 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.72 -35.52 22.29 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.156 0.428 . . . . 0.0 112.156 -177.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . 0.524 HG22 ' O ' ' B' ' 698' ' ' VAL . 33.8 m -59.82 -32.03 48.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 120.07 -0.652 . . . . 0.0 110.668 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 20.0 tp -60.26 -38.3 83.09 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.799 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 6.4 t -57.93 -38.87 76.7 Favored 'General case' 0 C--O 1.22 -0.479 0 C-N-CA 120.73 -0.388 . . . . 0.0 110.975 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.9 tp -65.78 -42.8 90.36 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 120.434 -0.507 . . . . 0.0 110.072 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 39.8 t -71.25 -23.72 23.41 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.601 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -65.69 -14.82 62.03 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.046 0.387 . . . . 0.0 112.046 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.16 -30.97 17.28 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.531 -179.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 34.8 m -88.39 -25.61 5.83 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 120.773 -0.371 . . . . 0.0 111.492 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -96.79 140.04 31.95 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.742 -179.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 . . . . . 0 C--O 1.221 -0.438 0 CA-C-O 117.973 -1.013 . . . . 0.0 110.758 179.944 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.416 HD13 ' HZ2' ' B' ' 670' ' ' TRP . 23.1 tp . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 2.0 tp -143.49 113.39 7.15 Favored 'General case' 0 C--O 1.22 -0.491 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -146.09 163.76 34.28 Favored 'General case' 0 C--O 1.218 -0.582 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.744 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.425 HD23 ' HB3' ' A' ' 661' ' ' LEU . 10.5 mt -61.42 -38.78 88.35 Favored 'General case' 0 C--O 1.219 -0.527 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.851 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -72.87 -28.62 62.61 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.534 -179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -70.23 -44.13 69.21 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.594 -0.442 . . . . 0.0 110.154 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . 0.46 ' CD1' HD22 ' A' ' 661' ' ' LEU . 78.6 m95 -60.56 -57.05 14.37 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 120.676 -0.41 . . . . 0.0 110.368 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.57 -47.02 77.09 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.146 -179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 78.6 p -60.2 -31.94 70.63 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 123.224 0.328 . . . . 0.0 111.179 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.536 HD11 ' C19' ' C' ' 801' ' ' QOJ . 11.9 tp -64.19 -4.64 3.82 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 10.9 m95 -68.27 -6.59 24.65 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.818 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -63.17 -37.06 85.73 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 9.4 m95 -79.84 -22.68 42.69 Favored 'General case' 0 CA--C 1.555 1.142 0 N-CA-C 114.133 1.16 . . . . 0.0 114.133 -176.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 64.23 -71.42 0.07 Allowed 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.198 1.363 . . . . 0.0 112.462 178.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -50.84 -49.69 58.32 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 46.1 mm -65.96 -40.53 87.65 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 C-N-CA 120.512 -0.475 . . . . 0.0 110.666 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 2.2 m -58.93 -49.82 76.38 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.146 -179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -67.74 -40.53 84.15 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.516 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 45.4 t90 -60.53 -36.84 79.38 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.531 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 5.9 tp -76.9 -14.25 59.9 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -178.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 3.3 t90 -111.16 -19.12 12.82 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -95.0 -38.25 10.75 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.626 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 47.5 mm -57.57 -36.9 55.67 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.512 0 C-N-CA 120.162 -0.615 . . . . 0.0 109.659 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.7 -33.91 66.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.06 178.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -68.0 -41.58 84.67 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -56.25 -28.05 57.17 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.883 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.521 HD12 HG21 ' B' ' 686' ' ' ILE . 36.8 mm -58.2 -45.44 88.84 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.577 -177.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 41.1 mt -65.42 -40.79 89.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 21.2 mm -55.95 -41.13 66.4 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.496 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.734 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 61.3 t -67.12 -23.66 30.94 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 C-N-CA 120.033 -0.667 . . . . 0.0 111.942 -178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . 0.59 ' O ' HG22 ' C' ' 693' ' ' ILE . . . -59.63 -51.35 59.55 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-N 119.189 0.904 . . . . 0.0 111.555 179.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 2.0 m -72.72 -21.89 60.97 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 117.247 0.523 . . . . 0.0 112.181 -179.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.7 tp -55.95 -38.27 70.11 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.888 -178.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.747 HD11 ' HG3' ' A' ' 696' ' ' ARG . 0.0 OUTLIER -73.77 -23.03 18.89 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.579 -179.801 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.48 -47.43 89.91 Favored Glycine 0 CA--C 1.542 1.76 0 C-N-CA 120.577 -0.821 . . . . 0.0 112.102 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.506 ' O ' HD23 ' C' ' 695' ' ' LEU . 1.0 OUTLIER -56.54 -30.69 63.37 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -179.257 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 26.0 mmt180 -49.65 -34.92 19.69 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -177.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.593 HD13 ' NH2' ' A' ' 696' ' ' ARG . 7.2 tp -58.17 -40.27 76.66 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.944 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -175.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.456 HG12 ' O ' ' C' ' 695' ' ' LEU . 9.6 p -55.72 -28.55 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 CA-C-N 118.968 0.804 . . . . 0.0 111.449 -178.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -55.65 -35.32 65.83 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.37 -35.97 65.85 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.318 -177.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 77.5 t -64.73 -31.66 54.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 120.181 -0.608 . . . . 0.0 109.77 178.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.9 tp -58.83 -40.76 85.13 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.77 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 95.1 p -62.32 -33.92 75.61 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.764 -0.374 . . . . 0.0 111.141 -179.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 19.5 tp -60.39 -42.9 96.86 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.13 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 27.2 m -83.2 -11.53 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.735 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -67.38 -21.05 65.63 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.45 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -73.53 -39.64 64.62 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.498 -179.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 46.4 t -89.4 -35.94 8.16 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.54 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.236 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 5.8 mtt180 -120.89 158.79 26.89 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.308 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.41 -179.986 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . 0.438 ' C9 ' HD11 ' A' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . 0.536 ' C19' HD11 ' C' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.444 ' O ' ' O ' ' A' ' 661' ' ' LEU . 3.0 mp . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.467 ' O ' HD12 ' C' ' 663' ' ' LEU . 3.9 pp 39.75 -176.16 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 172.73 -179.07 0.07 Allowed 'General case' 0 N--CA 1.478 0.94 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.128 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.689 HD13 ' N ' ' A' ' 664' ' ' ASP . 0.0 OUTLIER -58.88 -40.59 84.84 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-O 120.791 0.329 . . . . 0.0 110.244 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . 0.689 ' N ' HD13 ' A' ' 663' ' ' LEU . 37.0 t70 -73.94 -23.97 59.59 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.851 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -67.06 -45.45 77.33 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.293 -179.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 94.6 m95 -64.47 -38.61 91.64 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.978 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . 0.675 ' HB2' ' CD1' ' B' ' 660' ' ' LEU . . . -72.8 -47.18 48.66 Favored 'General case' 0 C--O 1.22 -0.477 0 C-N-CA 120.477 -0.489 . . . . 0.0 111.508 -179.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 89.9 p -59.58 -31.64 69.63 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.469 -0.492 . . . . 0.0 110.038 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.611 HD11 HG22 ' A' ' 675' ' ' ILE . 56.6 tp -56.47 -26.78 55.15 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.881 -0.6 . . . . 0.0 112.062 -179.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -68.54 -9.95 52.56 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 119.512 -0.875 . . . . 0.0 111.997 -179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -62.76 -48.85 77.37 Favored 'General case' 0 C--O 1.218 -0.587 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.583 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -103.68 -22.57 13.55 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 121.011 -0.276 . . . . 0.0 110.347 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 48.2 p90 41.39 22.05 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -63.89 -52.8 58.28 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.782 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.611 HG22 HD11 ' A' ' 669' ' ' LEU . 0.3 OUTLIER -68.67 -33.22 58.49 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.748 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.581 -179.202 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 51.7 p -58.44 -37.78 76.13 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.619 -178.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -60.57 -41.64 95.03 Favored 'General case' 0 C--O 1.216 -0.658 0 C-N-CA 119.852 -0.739 . . . . 0.0 109.344 178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 7.0 t90 -72.81 -46.42 53.22 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.405 HD23 ' O ' ' A' ' 679' ' ' LEU . 0.6 OUTLIER -91.54 -33.46 15.15 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.593 0.961 . . . . 0.0 113.593 -176.138 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.15 -11.02 60.38 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.287 -179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -110.16 -30.1 7.89 Favored 'General case' 0 C--O 1.218 -0.574 0 C-N-CA 121.093 -0.243 . . . . 0.0 110.603 179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.442 ' O ' HD13 ' A' ' 686' ' ' ILE . 1.2 mm -60.0 -43.83 93.35 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 45.9 ttp180 -62.2 -48.45 79.95 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.244 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 80.0 mt -64.12 -44.06 97.55 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 120.94 -0.304 . . . . 0.0 111.454 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -52.65 -27.83 18.93 Favored 'General case' 0 C--O 1.217 -0.617 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.771 HG21 HD11 ' B' ' 686' ' ' ILE . 1.2 mp -57.54 -48.38 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.218 -177.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 49.1 mt -58.59 -41.92 83.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.321 179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 69.1 mt -60.19 -45.18 96.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.9 -179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . . . . . . . . . 13.4 m -68.81 2.0 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 119.811 -0.755 . . . . 0.0 112.27 -179.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -85.6 -64.2 1.51 Allowed Glycine 0 C--N 1.347 1.173 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 29.8 m -52.1 -25.16 8.12 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 120.611 -0.435 . . . . 0.0 110.683 178.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.636 HD23 HD11 ' C' ' 693' ' ' ILE . 2.3 tp -54.03 -32.58 54.79 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.785 179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -35.39 73.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.156 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.919 -178.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.02 -56.28 5.87 Favored Glycine 0 CA--C 1.537 1.43 0 C-N-CA 120.007 -1.092 . . . . 0.0 113.767 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.753 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.0 OUTLIER -60.36 -31.6 70.48 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 118.992 1.396 . . . . 0.0 110.456 179.905 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.529 ' H ' HD13 ' A' ' 695' ' ' LEU . 20.1 tpp180 -50.74 -35.88 33.68 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-O 120.723 0.297 . . . . 0.0 110.348 177.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 58.1 mt -59.21 -40.35 80.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.773 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.782 -178.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.753 HG12 ' O ' ' A' ' 695' ' ' LEU . 3.5 p -55.55 -28.06 22.27 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.807 0 C-N-CA 120.651 -0.42 . . . . 0.0 111.347 -178.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -55.04 -35.4 64.42 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.929 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.78 -35.59 66.43 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 116.495 -0.321 . . . . 0.0 110.911 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.664 HG12 ' O ' ' A' ' 698' ' ' VAL . 1.7 p -59.88 -34.2 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.075 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.05 -24.84 67.86 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.284 179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 32.1 m -57.87 -44.75 86.83 Favored 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.9 -0.32 . . . . 0.0 110.778 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 19.7 tp -65.54 -40.39 92.84 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 61.6 t -60.61 -28.33 42.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.342 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -63.33 -7.33 6.13 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.43 0.53 . . . . 0.0 112.43 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 11.2 ttp85 -73.6 -44.82 56.18 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.485 -179.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 43.0 t -89.42 -36.03 8.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.219 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 38.23 46.99 0.94 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 58.3 tp60 . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 118.017 -0.992 . . . . 0.0 111.037 179.753 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.675 ' CD1' ' HB2' ' A' ' 667' ' ' ALA . 55.8 mt . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.642 ' H ' HD23 ' A' ' 663' ' ' LEU . 0.2 OUTLIER -146.84 135.36 21.97 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.287 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -168.75 137.99 2.23 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.31 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.579 HD22 ' C ' ' B' ' 663' ' ' LEU . 0.0 OUTLIER -55.01 -18.25 4.89 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.356 179.892 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -72.48 -31.46 65.4 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 121.058 -0.257 . . . . 0.0 110.753 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 62.9 mmtt -69.43 -44.91 70.36 Favored 'General case' 0 C--O 1.218 -0.57 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.369 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 85.4 m95 -66.23 -38.84 88.88 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.839 -0.344 . . . . 0.0 111.355 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.4 -35.83 71.17 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.144 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 2.9 t -54.98 -31.44 60.86 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.075 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.421 HD22 ' CH2' ' B' ' 672' ' ' TRP . 8.7 mt -62.9 -14.8 50.95 Favored 'General case' 0 CA--C 1.543 0.698 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.934 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.3 m95 -68.79 -28.27 66.62 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.732 -0.387 . . . . 0.0 111.962 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -62.83 -47.93 81.26 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.508 -0.477 . . . . 0.0 112.197 -178.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . 0.59 ' CZ3' HG22 ' B' ' 675' ' ' ILE . 0.0 OUTLIER -103.44 -22.46 13.65 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.717 -178.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 53.45 7.83 0.11 Allowed 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 178.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -63.45 -53.22 55.63 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 119.291 0.95 . . . . 0.0 112.276 -178.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.59 HG22 ' CZ3' ' B' ' 672' ' ' TRP . 8.8 tp -68.97 -32.8 55.98 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.75 0 C-N-CA 119.891 -0.724 . . . . 0.0 111.632 179.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -59.02 -46.77 87.36 Favored 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.441 -178.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -64.68 -46.67 81.45 Favored 'General case' 0 C--O 1.216 -0.697 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.823 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.556 ' CE3' HD12 ' B' ' 675' ' ' ILE . 5.4 t90 -65.18 -38.19 89.74 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.088 -179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.401 HD13 ' O ' ' B' ' 679' ' ' LEU . 0.1 OUTLIER -87.42 -19.34 28.2 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.717 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -100.61 9.68 42.17 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.619 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -129.99 -1.24 4.68 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.525 178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.412 ' O ' HD12 ' B' ' 686' ' ' ILE . 12.7 tt -68.46 -44.18 83.4 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 N-CA-C 112.034 0.383 . . . . 0.0 112.034 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 17.1 ttm105 -55.81 -47.89 76.37 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.498 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . 0.5 ' N ' HD12 ' B' ' 684' ' ' ILE . 2.2 mp -64.54 -36.92 78.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.773 179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.448 ' O ' HG23 ' B' ' 689' ' ' VAL . 46.1 t80 -52.01 -39.09 58.94 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 119.101 -0.476 . . . . 0.0 112.26 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.771 HD11 HG21 ' A' ' 686' ' ' ILE . 3.2 mp -60.27 -38.55 77.83 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 119.79 -0.764 . . . . 0.0 109.956 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.77 -41.91 83.92 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 -179.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . 0.568 ' H ' HD12 ' B' ' 688' ' ' ILE . 3.8 mp -66.69 -42.19 89.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 177.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.461 ' O ' HG12 ' B' ' 689' ' ' VAL . 66.1 t -68.52 -1.78 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.202 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.151 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -91.75 -45.57 3.92 Favored Glycine 0 C--N 1.35 1.343 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 27.3 m -53.52 -30.13 39.96 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.121 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 8.4 mp -61.71 -36.3 80.52 Favored 'General case' 0 C--O 1.221 -0.444 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.034 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.747 HG21 HD23 ' C' ' 692' ' ' LEU . 0.3 OUTLIER -59.27 -33.37 50.66 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 120.164 -0.614 . . . . 0.0 110.756 -179.302 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -70.03 -36.46 72.63 Favored Glycine 0 CA--C 1.534 1.241 0 N-CA-C 110.909 -0.876 . . . . 0.0 110.909 179.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.54 ' O ' HG22 ' B' ' 698' ' ' VAL . 1.0 OUTLIER -56.14 -31.6 63.49 Favored 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 121.023 -0.271 . . . . 0.0 111.426 -178.85 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -50.16 -31.56 13.89 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 179.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.602 HD11 ' NH2' ' C' ' 696' ' ' ARG . 48.7 mm -59.91 -48.29 88.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.427 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.54 HG22 ' O ' ' B' ' 695' ' ' LEU . 16.1 m -66.75 -28.36 42.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.752 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -55.49 -26.82 44.77 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.442 -0.503 . . . . 0.0 111.623 -179.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -57.6 -40.68 79.62 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.459 -0.496 . . . . 0.0 109.875 179.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 63.0 t -64.49 -42.62 95.76 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.7 tt -62.11 -38.64 89.66 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.472 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 68.1 m -57.91 -34.54 69.95 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.963 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 18.8 tp -66.1 -42.1 89.7 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.995 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 47.0 t -65.69 -17.43 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.915 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 14.3 t-20 -60.96 -26.2 67.37 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.465 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -73.79 -36.45 65.04 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.851 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 43.0 t -82.91 -36.13 12.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.273 -179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 66.3 mtm180 -144.01 130.92 20.39 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.709 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 C--O 1.22 -0.479 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.648 -179.97 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 3.1 tt . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 28.3 mt -136.27 132.04 35.22 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -170.6 -176.51 2.12 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.099 -179.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.467 HD12 ' O ' ' A' ' 661' ' ' LEU . 8.1 tt -52.45 -31.39 34.47 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.371 -179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -71.21 -40.35 71.2 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.707 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 44.7 mmtt -70.22 -43.51 70.5 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.169 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -60.24 -44.67 95.03 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.96 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -66.63 -41.04 88.93 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.534 -179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 20.1 m -56.58 -31.94 64.73 Favored 'General case' 0 C--O 1.218 -0.56 0 C-N-CA 120.717 -0.393 . . . . 0.0 111.269 -179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 9.2 tp -70.48 -4.72 24.15 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 9.1 m95 -72.71 -13.77 61.41 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -178.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -62.77 -50.42 71.12 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 118.291 -1.364 . . . . 0.0 110.593 -178.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . 0.415 ' O ' ' N ' ' C' ' 674' ' ' ASP . 0.3 OUTLIER -101.75 -23.35 14.22 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 178.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 49.0 p90 42.01 9.19 0.0 OUTLIER 'General case' 0 C--N 1.362 1.128 0 N-CA-C 116.408 2.003 . . . . 0.0 116.408 178.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . 0.415 ' N ' ' O ' ' C' ' 672' ' ' TRP . 30.2 t70 -64.22 -53.97 40.9 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 120.156 1.344 . . . . 0.0 110.662 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 9.3 tp -69.88 -29.67 41.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.454 178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 17.3 m -58.45 -40.02 81.5 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.504 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -60.43 -46.31 90.5 Favored 'General case' 0 C--O 1.217 -0.619 0 C-N-CA 119.964 -0.694 . . . . 0.0 109.564 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.482 ' O ' HG22 ' C' ' 682' ' ' ILE . 28.3 t90 -56.84 -39.09 73.6 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.259 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -79.01 -2.87 42.31 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -179.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 4.7 t90 -146.83 44.06 1.17 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 119.772 -0.771 . . . . 0.0 112.325 -179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 19.5 m-85 -161.18 -42.32 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.725 HD13 ' O ' ' C' ' 682' ' ' ILE . 0.1 OUTLIER -55.88 -36.91 45.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.788 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 178.49 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 3.5 ptt-85 -55.81 -40.73 73.16 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 40.5 mm -59.85 -41.3 85.3 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.49 ' HA ' HD13 ' C' ' 688' ' ' ILE . 1.3 t80 -67.09 -27.77 67.63 Favored 'General case' 0 C--O 1.218 -0.605 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.807 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.685 ' CG2' HD11 ' A' ' 686' ' ' ILE . 1.1 tp -57.89 -43.6 84.83 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.727 -177.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 39.2 mt -59.27 -41.64 84.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.027 -179.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.591 ' H ' HD12 ' C' ' 688' ' ' ILE . 3.4 mp -56.82 -41.5 75.81 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.653 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 52.4 t -67.67 -31.38 52.2 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.126 0 CA-C-O 118.684 -0.674 . . . . 0.0 112.197 -177.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -62.74 -53.48 40.83 Favored Glycine 0 CA--C 1.538 1.491 0 CA-C-N 119.415 1.007 . . . . 0.0 111.632 179.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.5 m -61.83 -24.39 66.86 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 117.231 0.515 . . . . 0.0 112.377 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . 0.747 HD23 HG21 ' B' ' 693' ' ' ILE . 2.5 tp -54.22 -32.63 56.36 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.711 -178.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.636 HD11 HD23 ' A' ' 692' ' ' LEU . 2.3 pp -70.19 -28.07 34.48 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 120.259 -0.576 . . . . 0.0 111.134 -178.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.71 -55.27 23.57 Favored Glycine 0 CA--C 1.542 1.778 0 C-N-CA 121.182 -0.532 . . . . 0.0 113.125 -178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 1.3 tt -58.42 -36.45 73.63 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.424 0.898 . . . . 0.0 113.424 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.602 ' NH2' HD11 ' B' ' 697' ' ' ILE . 0.3 OUTLIER -50.56 -35.85 31.78 Favored 'General case' 0 C--O 1.218 -0.56 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -178.725 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.62 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.2 OUTLIER -59.18 -41.02 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.18 -178.177 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.772 ' O ' HG12 ' C' ' 701' ' ' VAL . 64.9 t -56.49 -29.0 27.91 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.827 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -56.05 -35.25 66.7 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.35 -34.93 64.69 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.103 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . 0.772 HG12 ' O ' ' C' ' 698' ' ' VAL . 9.3 p -59.06 -31.53 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.5 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 9.7 tt -58.59 -30.54 67.27 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 120.988 -0.285 . . . . 0.0 110.391 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 6.3 t -57.93 -39.0 76.95 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.849 -0.341 . . . . 0.0 110.428 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 16.3 tp -56.51 -31.21 63.87 Favored 'General case' 0 C--O 1.218 -0.588 0 C-N-CA 120.635 -0.426 . . . . 0.0 109.871 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.8 t -75.66 -17.57 15.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.042 179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -60.66 -22.36 63.77 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -85.18 -3.7 58.9 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 120.625 -0.43 . . . . 0.0 112.018 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 48.3 t -104.41 -36.03 3.77 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.534 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.319 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 -123.94 176.61 6.22 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.959 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 118.369 -0.824 . . . . 0.0 112.3 -179.806 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.513 HD23 ' N ' ' A' ' 660' ' ' LEU . 1.4 pt? . . . . . 0 N--CA 1.489 1.52 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 9.5 mp -99.72 155.38 17.66 Favored 'General case' 0 C--O 1.219 -0.51 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.252 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -163.51 159.78 22.42 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.758 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 8.9 tt -61.83 -40.53 95.61 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.461 -0.496 . . . . 0.0 110.775 -179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -72.68 -23.91 60.94 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.478 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -64.41 -40.0 94.93 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 116.523 -0.308 . . . . 0.0 110.914 179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -70.25 -49.61 48.14 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.684 -0.406 . . . . 0.0 111.148 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -65.81 -31.38 72.32 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.805 -0.358 . . . . 0.0 111.48 -179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 1.8 m -57.43 -31.59 66.05 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.112 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 70.4 mt -71.27 -4.83 27.97 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -179.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 44.5 m0 -68.98 -1.0 6.37 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -177.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -62.32 -49.17 76.69 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 118.41 -1.316 . . . . 0.0 111.887 -176.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -104.23 -11.04 17.46 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.832 177.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.3 p90 43.33 18.84 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -64.42 -52.93 55.61 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 120.478 -0.489 . . . . 0.0 110.507 179.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.547 HD11 ' CE3' ' A' ' 678' ' ' TRP . 7.1 tp -68.84 -28.35 39.41 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 CA-C-N 115.829 -0.623 . . . . 0.0 112.316 -179.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 75.7 p -58.9 -40.35 84.2 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 119.818 -0.753 . . . . 0.0 109.386 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.7 m-80 -65.33 -33.83 76.9 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.077 -0.511 . . . . 0.0 109.807 178.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.638 ' CD1' HG21 ' A' ' 682' ' ' ILE . 42.3 t90 -69.83 -44.56 69.72 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.868 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.68 -2.6 7.17 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.85 -0.614 . . . . 0.0 112.222 -178.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -136.48 -58.43 0.74 Allowed 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 119.723 -0.791 . . . . 0.0 112.874 -178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 13.6 m-85 -72.52 -41.44 65.88 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 120.482 -0.487 . . . . 0.0 112.258 -177.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.638 HG21 ' CD1' ' A' ' 678' ' ' TRP . 28.9 mm -67.26 -36.44 76.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -55.29 -48.03 74.68 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 121.153 -0.219 . . . . 0.0 111.185 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.91 -43.14 91.52 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.097 0 C-N-CA 120.991 -0.283 . . . . 0.0 111.178 -179.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.425 ' HA ' HD13 ' A' ' 688' ' ' ILE . 3.2 t80 -52.57 -28.71 22.1 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 112.581 0.586 . . . . 0.0 112.581 -177.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.53 HG12 HG21 ' C' ' 686' ' ' ILE . 1.4 mp -57.95 -37.83 63.19 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 CA-C-O 119.188 -0.434 . . . . 0.0 111.18 -179.11 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 69.5 mt -58.11 -41.95 81.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.077 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . 0.581 ' H ' HD12 ' A' ' 688' ' ' ILE . 5.1 mp -64.56 -40.97 90.91 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.765 ' O ' HD11 ' A' ' 692' ' ' LEU . 21.9 t -68.32 4.38 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -178.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -110.71 -5.77 27.29 Favored Glycine 0 CA--C 1.543 1.828 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 178.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 54.2 m -88.24 -32.84 18.33 Favored 'General case' 0 C--O 1.219 -0.545 0 CA-C-N 117.141 0.471 . . . . 0.0 111.343 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.765 HD11 ' O ' ' A' ' 689' ' ' VAL . 0.2 OUTLIER -53.67 -32.6 52.29 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.089 -178.237 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.734 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.1 OUTLIER -54.82 -34.18 29.98 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.956 0 C-N-CA 120.3 -0.56 . . . . 0.0 109.898 179.692 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -73.42 -43.82 36.22 Favored Glycine 0 C--N 1.346 1.117 0 N-CA-C 108.902 -1.679 . . . . 0.0 108.902 177.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.437 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.4 OUTLIER -56.43 -37.43 70.2 Favored 'General case' 0 C--O 1.212 -0.874 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.151 179.427 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -50.68 -35.37 30.58 Favored 'General case' 0 C--O 1.216 -0.686 0 C-N-CA 122.776 0.431 . . . . 0.0 111.152 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 75.2 mt -59.31 -41.97 85.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 CA-C-O 118.994 -0.527 . . . . 0.0 111.214 -176.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.437 HG12 ' O ' ' A' ' 695' ' ' LEU . 2.4 p -67.6 -28.49 42.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.034 0 CA-C-N 118.956 0.798 . . . . 0.0 111.074 179.285 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -55.06 -35.01 64.06 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.461 0.172 . . . . 0.0 110.642 -179.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.42 -35.49 65.44 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.895 -178.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 698' ' ' VAL . 0.5 OUTLIER -60.59 -38.23 77.7 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.758 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . 0.427 ' O ' HG22 ' A' ' 705' ' ' VAL . 0.0 OUTLIER -61.62 -29.07 69.81 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.755 -179.847 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 4.0 t -63.62 -31.91 73.22 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.101 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 30.6 tp -62.73 -39.52 94.35 Favored 'General case' 0 C--O 1.218 -0.588 0 O-C-N 123.102 0.251 . . . . 0.0 111.085 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 702' ' ' LEU . 35.1 m -82.65 -10.8 12.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -63.81 -24.06 67.6 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 120.725 -0.39 . . . . 0.0 112.027 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 12.6 ptt-85 -76.6 -19.13 58.18 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 120.378 -0.529 . . . . 0.0 112.305 -179.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 6.7 m -104.99 26.05 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 55.2 mtm180 -86.53 152.95 22.2 Favored 'General case' 0 C--O 1.218 -0.559 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.572 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 118.068 -0.967 . . . . 0.0 110.917 -179.908 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.411 ' O ' HD12 ' B' ' 660' ' ' LEU . 3.6 pp . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.513 HD22 ' CZ2' ' B' ' 666' ' ' TRP . 70.2 mt -124.65 154.61 40.48 Favored 'General case' 0 C--O 1.22 -0.479 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.101 -179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 67.0 mt-10 -147.83 145.87 28.89 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.783 179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.43 HD23 ' O ' ' B' ' 663' ' ' LEU . 4.6 tt -54.95 -40.01 69.52 Favored 'General case' 0 C--O 1.219 -0.523 0 CA-C-O 121.016 0.436 . . . . 0.0 110.325 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -68.57 -35.46 77.43 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.58 -0.737 . . . . 0.0 111.701 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 31.1 ttpt -68.14 -43.04 79.21 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.45 -179.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . 0.513 ' CZ2' HD22 ' B' ' 661' ' ' LEU . 83.3 m95 -59.75 -48.71 80.59 Favored 'General case' 0 C--O 1.22 -0.449 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.374 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -54.23 -33.03 57.47 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.757 -179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -58.51 -32.97 69.32 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 120.053 -0.659 . . . . 0.0 110.098 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.789 HD11 HG23 ' B' ' 675' ' ' ILE . 49.0 tp -59.53 -17.34 31.43 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.712 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 11.6 m0 -68.64 -17.07 64.03 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -179.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -89.46 -16.65 30.34 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -86.49 -22.66 26.3 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.291 -0.564 . . . . 0.0 112.32 -177.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 41.0 t80 59.87 -73.06 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 113.773 1.027 . . . . 0.0 113.773 178.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -51.44 -53.01 41.37 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -176.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.789 HG23 HD11 ' B' ' 669' ' ' LEU . 5.0 tp -68.27 -27.93 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.77 0 C-N-CA 119.829 -0.749 . . . . 0.0 110.777 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 7.3 m -63.25 -48.28 78.88 Favored 'General case' 0 C--O 1.218 -0.571 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.589 179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -71.24 -41.36 70.23 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.785 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.571 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.5 t90 -62.81 -44.22 96.74 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.331 -179.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.453 HD13 HD11 ' B' ' 675' ' ' ILE . 0.5 OUTLIER -75.78 -27.51 58.04 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.557 -178.126 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 6.6 t90 -91.89 0.02 57.49 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -119.0 -6.28 10.5 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.626 -0.43 . . . . 0.0 112.092 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.571 HG23 ' O ' ' B' ' 678' ' ' TRP . 7.8 pt -63.44 -42.65 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 120.144 -0.622 . . . . 0.0 111.669 -179.617 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -43.95 77.01 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.769 -179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 56.8 mt -66.65 -37.74 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 178.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -55.8 -29.97 60.59 Favored 'General case' 0 C--O 1.218 -0.601 0 C-N-CA 121.112 -0.235 . . . . 0.0 111.47 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.599 HG21 HG13 ' C' ' 686' ' ' ILE . 27.2 mm -60.02 -41.84 87.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 121.013 -0.275 . . . . 0.0 110.45 -179.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.82 -41.82 83.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . 0.516 HD12 ' N ' ' B' ' 688' ' ' ILE . 2.8 mp -61.93 -42.33 94.31 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 N-CA-C 108.76 -0.83 . . . . 0.0 108.76 178.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.463 ' O ' HG12 ' B' ' 689' ' ' VAL . 60.0 t -68.64 -2.14 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 120.691 -0.404 . . . . 0.0 111.237 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . 0.49 ' O ' HG22 ' B' ' 693' ' ' ILE . . . -86.33 -55.83 2.4 Favored Glycine 0 C--N 1.351 1.368 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 21.9 m -58.08 -30.79 66.5 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.741 179.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 1.3 tp -54.71 -34.35 62.26 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.772 -179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.679 HD11 ' HG3' ' C' ' 696' ' ' ARG . 0.3 OUTLIER -73.91 -27.76 23.0 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.88 0 C-N-CA 120.349 -0.541 . . . . 0.0 111.321 -179.334 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -67.86 -41.65 87.85 Favored Glycine 0 C--N 1.343 0.931 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.53 -31.79 64.48 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 121.249 -0.18 . . . . 0.0 111.021 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.98 -30.94 16.39 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 179.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 58.9 mt -59.44 -41.53 84.84 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.085 -177.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 47.4 t -65.28 -28.59 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.496 179.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.47 -26.66 43.69 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 120.575 -0.45 . . . . 0.0 111.035 -179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -51.37 -37.04 46.01 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 120.483 -0.487 . . . . 0.0 109.735 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 75.7 t -64.27 -42.42 95.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.547 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.53 -29.09 69.78 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.035 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 20.9 t -57.98 -32.35 67.79 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.609 -0.437 . . . . 0.0 111.279 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 26.1 tp -66.08 -40.94 91.22 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 120.294 -0.562 . . . . 0.0 110.241 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 98.1 t -64.63 -25.62 38.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.788 0 C-N-CA 120.726 -0.389 . . . . 0.0 110.17 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -67.27 -13.07 61.64 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 121.057 -0.257 . . . . 0.0 111.433 178.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.26 -31.74 13.33 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-O 120.396 0.141 . . . . 0.0 110.671 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.539 HG12 ' O ' ' B' ' 708' ' ' VAL . 20.4 t -87.79 25.96 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.822 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.398 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 12.4 mmt180 -50.61 117.89 2.73 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 122.148 -0.345 . . . . 0.0 111.29 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 . . . . . 0 C--O 1.221 -0.443 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.369 -179.998 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.493 1.694 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.51 ' O ' HD12 ' C' ' 661' ' ' LEU . 4.2 pp -162.58 151.25 14.75 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-O 120.807 0.337 . . . . 0.0 111.219 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -171.26 179.25 3.04 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.903 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.11 -30.99 71.4 Favored 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.449 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.49 -36.44 78.93 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.651 -0.419 . . . . 0.0 110.845 -179.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 59.1 mmtt -70.43 -42.37 71.66 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.499 -0.48 . . . . 0.0 110.369 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 61.6 m95 -70.4 -53.99 14.25 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.62 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.58 -37.51 75.93 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 1.4 t -62.83 -33.46 75.28 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.844 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.581 HD21 HG23 ' C' ' 675' ' ' ILE . 19.9 tp -70.99 -5.28 29.95 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 9.2 m0 -68.58 -6.11 23.68 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -79.9 -49.64 11.62 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 119.567 -0.853 . . . . 0.0 113.269 -178.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -89.94 -23.77 21.48 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 114.738 1.384 . . . . 0.0 114.738 -178.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 55.17 -10.26 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 178.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -63.9 -54.53 33.28 Favored 'General case' 0 C--N 1.352 0.715 0 CA-C-N 120.465 1.484 . . . . 0.0 112.381 -178.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.581 HG23 HD21 ' C' ' 669' ' ' LEU . 7.9 tp -70.14 -32.81 52.31 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 120.356 -0.538 . . . . 0.0 110.962 178.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 5.0 m -58.77 -39.07 79.93 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.916 -178.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -59.73 -47.51 85.36 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 120.365 -0.534 . . . . 0.0 109.692 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 19.5 t90 -72.61 -28.27 62.67 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.132 178.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.419 HD23 HG13 ' C' ' 675' ' ' ILE . 0.2 OUTLIER -67.45 -4.05 10.21 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.521 -179.113 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -142.48 -179.09 6.09 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 64.58 -11.3 0.13 Allowed 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.01 -37.07 59.18 Favored 'Isoleucine or valine' 0 C--N 1.352 0.674 0 CA-C-N 119.444 1.02 . . . . 0.0 110.5 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 41.0 mtt85 -60.71 -48.3 82.41 Favored 'General case' 0 C--O 1.217 -0.608 0 C-N-CA 120.821 -0.351 . . . . 0.0 110.886 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.537 ' O ' HD12 ' C' ' 688' ' ' ILE . 97.4 mt -62.7 -44.07 99.16 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.725 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.434 ' HA ' HD13 ' C' ' 688' ' ' ILE . 0.1 OUTLIER -63.76 -28.53 69.94 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 123.484 0.49 . . . . 0.0 110.154 178.915 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.599 HG13 HG21 ' B' ' 686' ' ' ILE . 0.9 OUTLIER -58.64 -38.77 73.34 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.832 -178.659 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 45.7 mt -67.11 -42.92 88.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 120.918 -0.313 . . . . 0.0 111.268 -178.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.537 HD12 ' O ' ' C' ' 684' ' ' ILE . 4.0 mp -57.97 -41.06 79.33 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 CA-C-O 119.477 -0.297 . . . . 0.0 111.772 -178.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.598 ' O ' HD11 ' C' ' 692' ' ' LEU . 38.3 t -67.56 -20.06 25.91 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 -176.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -90.77 14.38 63.28 Favored Glycine 0 CA--C 1.545 1.942 0 CA-C-N 119.994 1.27 . . . . 0.0 113.409 -178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.6 m -88.68 -34.25 17.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.365 1.083 . . . . 0.0 112.418 -179.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . 0.598 HD11 ' O ' ' C' ' 689' ' ' VAL . 0.2 OUTLIER -61.16 -33.09 72.86 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.982 -178.369 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.525 ' H ' HD12 ' C' ' 692' ' ' LEU . 2.1 pp -57.81 -40.05 74.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 C-N-CA 119.794 -0.762 . . . . 0.0 110.267 -178.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.9 -53.36 46.98 Favored Glycine 0 CA--C 1.539 1.593 0 N-CA-C 110.976 -0.849 . . . . 0.0 110.976 179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 7.7 tt -56.63 -31.6 64.49 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.679 ' HG3' HD11 ' B' ' 693' ' ' ILE . 23.6 mmt180 -50.55 -36.52 34.83 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.226 0.825 . . . . 0.0 113.226 -178.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.63 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.2 OUTLIER -59.67 -41.64 85.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.582 -177.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.6 -28.87 45.83 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 177.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.64 -35.16 73.84 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.667 179.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.3 -35.41 65.06 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.148 -176.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 80.4 t -59.54 -31.41 46.72 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.029 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.4 tp -58.34 -34.29 70.47 Favored 'General case' 0 C--O 1.219 -0.547 0 C-N-CA 120.68 -0.408 . . . . 0.0 110.418 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 29.2 p -58.0 -37.61 74.6 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.561 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 12.8 tp -57.59 -39.9 77.84 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.671 -0.411 . . . . 0.0 109.946 179.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 28.9 t -72.82 -31.43 36.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.702 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 13.4 t-20 -60.92 -8.82 3.43 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -109.65 -32.84 6.96 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 110.205 -0.294 . . . . 0.0 110.205 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 39.8 t -82.94 -29.13 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.649 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.835 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 28.8 ttp180 -130.92 122.43 26.94 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 120.848 -0.341 . . . . 0.0 111.042 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 . . . . . 0 C--O 1.221 -0.431 0 CA-C-O 118.136 -0.935 . . . . 0.0 110.944 179.994 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.511 HD22 ' N ' ' A' ' 660' ' ' LEU . 3.6 mm? . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.679 ' O ' HD23 ' C' ' 663' ' ' LEU . 44.4 mt 60.23 115.31 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.144 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -165.65 168.5 16.21 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.208 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.522 ' O ' HD23 ' A' ' 663' ' ' LEU . 5.3 tt -52.52 -38.82 60.47 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 120.808 -0.357 . . . . 0.0 110.823 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -72.15 -34.62 68.65 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.518 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -68.18 -44.32 76.16 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.356 -179.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -58.7 -44.1 90.24 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-O 120.815 0.34 . . . . 0.0 110.942 -179.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . 0.462 ' CB ' HD22 ' B' ' 660' ' ' LEU . . . -51.68 -19.66 1.69 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.504 -0.771 . . . . 0.0 112.142 -178.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 32.1 t -64.69 -32.65 74.42 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.421 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.423 HD22 ' N ' ' A' ' 669' ' ' LEU . 4.2 mm? -69.82 -20.49 63.44 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 32.0 m95 -68.89 -17.22 63.94 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.607 -0.437 . . . . 0.0 110.905 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 18.2 t30 -63.24 -35.49 80.52 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.508 0.558 . . . . 0.0 112.508 -179.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 3.9 m95 -94.84 -23.44 17.48 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 119.76 -0.776 . . . . 0.0 111.099 -179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 18.5 t80 66.8 -41.74 0.4 Allowed 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 178.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.0 -52.09 64.32 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -177.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.474 HD11 ' CE3' ' A' ' 678' ' ' TRP . 8.1 tp -62.92 -29.91 48.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.719 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.177 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.4 m -59.69 -37.57 79.16 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.835 178.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -66.27 -23.16 66.35 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.503 179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.474 ' CE3' HD11 ' A' ' 675' ' ' ILE . 4.9 t90 -72.05 -46.4 57.14 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 120.31 -0.556 . . . . 0.0 111.225 -179.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.11 -24.45 19.12 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -177.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 9.6 t90 -74.07 -0.59 16.96 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 119.397 -0.921 . . . . 0.0 111.607 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -128.31 -25.07 3.01 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.617 179.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . . . . . . . . . 2.4 tt -55.56 -36.6 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.874 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 26.9 ttp-105 -55.84 -48.42 75.52 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 29.3 mt -64.89 -45.97 93.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -52.83 -33.22 48.39 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 120.666 -0.414 . . . . 0.0 110.9 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.485 HG13 HG21 ' C' ' 686' ' ' ILE . 1.1 mp -58.4 -42.81 85.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.874 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 3.7 mm -58.44 -42.14 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 C-N-CA 119.907 -0.717 . . . . 0.0 109.564 179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 41.8 mm -57.08 -41.01 76.82 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 CA-C-N 116.965 -0.107 . . . . 0.0 110.958 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 689' ' ' VAL . 42.8 t -67.75 -0.09 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.994 0 C-N-CA 120.158 -0.617 . . . . 0.0 111.495 -178.134 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -84.97 -40.23 8.18 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 177.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 4.3 m -77.86 -16.92 57.91 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.461 179.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.5 tp -58.83 -44.04 90.8 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 120.769 -0.373 . . . . 0.0 110.171 -178.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.729 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.2 OUTLIER -63.0 -30.48 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 120.353 -0.539 . . . . 0.0 110.231 179.43 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -69.55 -37.82 78.34 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 109.335 -1.506 . . . . 0.0 109.335 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.641 ' O ' HG22 ' A' ' 698' ' ' VAL . 0.4 OUTLIER -56.57 -35.97 68.78 Favored 'General case' 0 C--O 1.21 -1.006 0 CA-C-O 120.572 0.225 . . . . 0.0 110.752 179.172 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.645 ' HG2' HD11 ' C' ' 693' ' ' ILE . 0.0 OUTLIER -50.55 -33.89 23.48 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 123.249 0.62 . . . . 0.0 111.479 178.308 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 77.3 mt -57.8 -40.08 74.13 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.031 0 CA-C-O 118.798 -0.62 . . . . 0.0 111.457 -175.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 695' ' ' LEU . 16.8 m -55.62 -28.21 22.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 CA-C-N 119.227 0.921 . . . . 0.0 110.77 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.451 ' HA ' ' HB3' ' A' ' 702' ' ' LEU . 28.9 m-85 -55.45 -36.43 66.53 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.58 -178.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.77 -48.02 78.83 Favored 'General case' 0 C--O 1.219 -0.553 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 178.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 96.3 t -64.92 -43.78 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . 0.451 ' HB3' ' HA ' ' A' ' 699' ' ' PHE . 0.6 OUTLIER -58.88 -24.81 62.72 Favored 'General case' 0 CA--C 1.551 0.998 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.729 178.629 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.7 -43.16 94.22 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.376 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.0 tp -65.27 -36.71 84.93 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-O 121.085 0.469 . . . . 0.0 110.062 179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 65.5 t -60.61 -36.1 68.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.052 -179.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -60.88 -8.74 3.34 Favored 'General case' 0 CA--C 1.545 0.788 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.888 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -73.95 -45.64 49.03 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 120.594 0.235 . . . . 0.0 111.038 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.473 ' O ' HG12 ' A' ' 708' ' ' VAL . 6.9 t -98.78 26.49 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.804 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.563 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -36.16 146.26 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 . . . . . 0 C--O 1.219 -0.528 0 CA-C-O 117.985 -1.007 . . . . 0.0 111.164 -179.245 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.477 ' HB2' HD21 ' A' ' 663' ' ' LEU . 39.6 mt . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 49.47 -152.04 0.15 Allowed 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.886 179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . 0.4 ' HB2' ' HB2' ' B' ' 665' ' ' LYS . 9.8 pt-20 -170.49 65.7 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 118.32 0.509 . . . . 0.0 111.272 -178.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.614 HD23 ' O ' ' B' ' 663' ' ' LEU . 5.8 tt -66.88 -41.11 87.76 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 119.981 -0.688 . . . . 0.0 111.974 -179.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -74.58 -29.28 61.27 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.05 -0.523 . . . . 0.0 112.092 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . 0.4 ' HB2' ' HB2' ' B' ' 662' ' ' GLU . 1.1 tptm -70.46 -25.46 63.19 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-O 118.889 -0.577 . . . . 0.0 111.917 -178.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . 0.727 ' CG ' HD12 ' C' ' 661' ' ' LEU . 91.9 m95 -58.91 -50.7 73.05 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 119.051 -1.059 . . . . 0.0 108.435 178.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.65 -41.89 95.8 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.996 -178.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 37.9 m -65.85 -31.74 72.87 Favored 'General case' 0 C--O 1.218 -0.592 0 C-N-CA 120.52 -0.472 . . . . 0.0 109.911 178.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 29.8 mt -72.46 -4.98 33.61 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.21 -0.45 . . . . 0.0 112.155 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 40.8 m0 -68.41 -3.0 9.74 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 120.358 -0.537 . . . . 0.0 111.574 179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 29.6 m-20 -89.38 -12.71 39.6 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 -178.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 11.2 m95 -88.92 -22.75 22.95 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.716 -179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 60.0 -72.38 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.959 0 N-CA-C 113.22 0.822 . . . . 0.0 113.22 178.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -51.74 -52.31 49.63 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.511 HD13 ' O ' ' B' ' 675' ' ' ILE . 0.3 OUTLIER -68.27 -31.12 50.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 C-N-CA 119.571 -0.852 . . . . 0.0 110.569 -179.31 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 26.9 m -58.74 -43.21 90.17 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.96 -37.83 83.77 Favored 'General case' 0 C--O 1.217 -0.658 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.108 178.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . . . . . . . . . 9.0 t90 -71.63 -42.08 68.04 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.045 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.13 -6.57 18.2 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 119.367 -0.933 . . . . 0.0 111.114 -179.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . 0.409 ' O ' ' HB2' ' B' ' 681' ' ' TYR . 1.9 t90 -129.61 176.4 8.02 Favored 'General case' 0 N--CA 1.441 -0.911 0 N-CA-C 107.374 -1.343 . . . . 0.0 107.374 177.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . 0.409 ' HB2' ' O ' ' B' ' 680' ' ' TRP . 96.7 m-85 72.36 -19.48 0.29 Allowed 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 27.2 pt -55.76 -37.05 45.37 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.646 0 CA-C-N 118.169 0.44 . . . . 0.0 110.453 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -59.59 -45.65 91.26 Favored 'General case' 0 C--O 1.219 -0.541 0 O-C-N 123.102 0.251 . . . . 0.0 110.408 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 38.1 mt -67.15 -38.08 80.45 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.43 -28.87 60.73 Favored 'General case' 0 C--O 1.217 -0.608 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.514 -178.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.89 HG21 HD12 ' C' ' 686' ' ' ILE . 22.4 mm -63.8 -41.06 91.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 120.226 -0.59 . . . . 0.0 110.842 -178.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . 0.546 ' H ' HD12 ' B' ' 687' ' ' ILE . 3.6 mp -58.82 -42.16 84.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . 0.604 ' H ' HD12 ' B' ' 688' ' ' ILE . 4.0 mp -62.82 -43.11 98.59 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 178.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.46 ' O ' HG12 ' B' ' 689' ' ' VAL . 97.0 t -68.55 -1.93 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.181 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.099 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -89.79 -61.47 1.36 Allowed Glycine 0 C--N 1.349 1.296 0 N-CA-C 110.619 -0.993 . . . . 0.0 110.619 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 2.9 m -53.22 -20.81 4.43 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.127 179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.434 HD23 HG21 ' A' ' 693' ' ' ILE . 1.0 OUTLIER -55.21 -32.58 62.37 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 121.247 -0.181 . . . . 0.0 110.841 -179.694 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.437 HG21 ' HB ' ' C' ' 693' ' ' ILE . 2.4 pp -68.5 -38.3 78.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.075 -179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . 0.691 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -65.58 -45.07 91.45 Favored Glycine 0 C--O 1.213 -1.195 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.706 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.87 -39.35 74.17 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -50.55 -31.41 15.61 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -179.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.691 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.9 tp -59.69 -41.58 85.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.767 0 C-N-CA 119.776 -0.77 . . . . 0.0 111.619 -177.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.406 ' O ' HG22 ' B' ' 701' ' ' VAL . 84.1 t -58.99 -28.31 38.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 C-N-CA 121.289 -0.164 . . . . 0.0 111.019 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -55.67 -24.87 36.62 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -49.22 -35.08 16.42 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 119.173 -0.441 . . . . 0.0 112.154 -177.469 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . 0.406 HG22 ' O ' ' B' ' 698' ' ' VAL . 34.8 m -59.24 -36.04 61.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 119.535 -0.866 . . . . 0.0 110.029 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 5.9 tt -68.52 -40.18 80.88 Favored 'General case' 0 C--O 1.218 -0.556 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 31.1 p -59.73 -31.94 70.08 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 120.861 -0.335 . . . . 0.0 110.711 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . 0.458 HD13 ' O ' ' B' ' 704' ' ' LEU . 0.2 OUTLIER -61.01 -25.59 67.01 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 120.662 -0.415 . . . . 0.0 109.973 179.294 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 59.1 t -90.22 -10.75 10.16 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.952 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -65.32 -10.74 35.24 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.218 0.821 . . . . 0.0 113.218 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 11.0 ptt180 -73.98 -39.23 63.82 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 119.817 -0.753 . . . . 0.0 110.82 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.466 HG12 ' O ' ' B' ' 708' ' ' VAL . 29.9 t -91.3 -4.42 10.74 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.342 -179.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 75.8 ttt-85 -57.47 132.97 54.75 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.46 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 17.7 pt20 . . . . . 0 C--O 1.22 -0.5 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.888 -179.964 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 4.2 mm? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 119.444 -0.313 . . . . 0.0 110.25 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.727 HD12 ' CG ' ' B' ' 666' ' ' TRP . 0.5 OUTLIER -67.84 -84.84 0.02 OUTLIER 'General case' 0 C--N 1.348 0.543 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.54 -179.224 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . 0.425 ' HG3' HD22 ' C' ' 661' ' ' LEU . 0.0 OUTLIER -175.68 72.45 0.02 OUTLIER 'General case' 0 C--N 1.354 0.773 0 CA-C-N 118.805 0.729 . . . . 0.0 112.283 -179.669 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.774 HD22 ' O ' ' C' ' 663' ' ' LEU . 0.0 OUTLIER -65.29 -40.07 93.35 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.057 179.077 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . 0.763 ' N ' HD13 ' C' ' 663' ' ' LEU . 22.5 t0 -74.37 -29.74 61.68 Favored 'General case' 0 C--O 1.218 -0.572 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -178.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 13.8 tptt -70.57 -29.36 65.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 120.067 -0.653 . . . . 0.0 111.452 -178.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 37.5 m95 -58.52 -49.61 76.75 Favored 'General case' 0 C--O 1.22 -0.447 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 179.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.39 90.86 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.527 178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 6.0 m -62.34 -31.02 71.6 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.661 178.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.472 ' HG ' HG23 ' C' ' 675' ' ' ILE . 9.7 tp -55.36 -16.64 3.74 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.379 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 26.2 m95 -68.66 -15.44 63.52 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.291 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 57.5 m-80 -62.59 -42.75 99.75 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 120.512 -0.475 . . . . 0.0 112.149 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 13.4 m95 -79.93 -22.38 42.77 Favored 'General case' 0 CA--C 1.552 1.048 0 N-CA-C 114.492 1.293 . . . . 0.0 114.492 -177.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 15.5 t80 70.22 -51.94 0.65 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 119.982 1.265 . . . . 0.0 112.711 178.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -52.44 63.0 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -178.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.472 HG23 ' HG ' ' C' ' 669' ' ' LEU . 6.4 tp -68.44 -30.97 49.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.393 -179.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 94.4 m -63.41 -50.28 70.43 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.844 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -68.6 -44.16 74.9 Favored 'General case' 0 C--O 1.219 -0.516 0 O-C-N 123.354 0.409 . . . . 0.0 110.951 -179.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.425 ' CE3' HD12 ' C' ' 675' ' ' ILE . 10.2 t90 -61.39 -43.56 98.66 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.937 -179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.577 ' O ' HD13 ' C' ' 679' ' ' LEU . 0.3 OUTLIER -78.92 -33.18 45.72 Favored 'General case' 0 C--O 1.22 -0.462 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.215 -179.22 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 21.9 t90 -59.61 -37.43 78.57 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.97 -178.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . 0.767 ' HB2' HD12 ' C' ' 684' ' ' ILE . 2.3 p90 -123.93 29.93 6.32 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 119.973 -0.691 . . . . 0.0 112.334 -178.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.407 HD13 ' NE1' ' C' ' 678' ' ' TRP . 7.1 tp -55.77 -37.03 45.35 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.66 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.859 178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.0 -34.66 78.5 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.239 -179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.767 HD12 ' HB2' ' C' ' 681' ' ' TYR . 95.0 mt -62.5 -46.22 96.92 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.556 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.623 ' HA ' HD12 ' C' ' 688' ' ' ILE . 2.3 m-85 -57.99 -29.54 65.34 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.381 -179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.89 HD12 HG21 ' B' ' 686' ' ' ILE . 21.8 mm -64.01 -44.1 97.76 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.524 0 C-N-CA 120.225 -0.59 . . . . 0.0 109.985 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 50.9 mt -58.96 -41.41 83.03 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.523 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.623 HD12 ' HA ' ' C' ' 685' ' ' PHE . 73.9 mt -56.58 -41.53 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 58.7 t -67.63 -31.5 52.76 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.042 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -57.19 -38.67 87.47 Favored Glycine 0 C--N 1.353 1.518 0 N-CA-C 110.669 -0.972 . . . . 0.0 110.669 178.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 10.7 m -78.28 -24.33 46.83 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 117.139 0.47 . . . . 0.0 111.183 179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -63.48 -43.58 96.87 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.217 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.645 HD11 ' HG2' ' A' ' 696' ' ' ARG . 0.6 OUTLIER -61.96 -38.21 80.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.156 179.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.73 -36.4 89.63 Favored Glycine 0 CA--C 1.544 1.884 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.315 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.487 ' O ' HD23 ' C' ' 695' ' ' LEU . 1.7 tt -55.99 -31.16 62.78 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 117.049 0.425 . . . . 0.0 111.87 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -49.98 -34.76 22.01 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 9.0 tp -58.24 -40.88 79.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -175.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . . . . . . . . . 9.2 p -56.12 -28.93 26.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 119.551 1.068 . . . . 0.0 110.992 -179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.58 -35.08 79.77 Favored 'General case' 0 C--O 1.217 -0.648 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.634 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.09 -35.78 64.96 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 120.688 -0.405 . . . . 0.0 111.522 -177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 69.9 t -60.0 -31.95 48.95 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.118 178.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 8.0 tt -58.87 -30.69 67.93 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.867 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 15.4 m -58.24 -40.49 81.9 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 120.767 -0.373 . . . . 0.0 110.246 179.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 16.3 tp -55.95 -26.8 49.63 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.622 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 20.4 t -81.59 -24.65 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.372 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -60.57 -20.83 61.63 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 -178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -74.05 -42.66 59.88 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 120.742 0.305 . . . . 0.0 110.558 -179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . 0.501 ' O ' HG12 ' C' ' 708' ' ' VAL . 20.4 t -97.32 2.23 10.34 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.372 -179.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? 56.64 172.51 0.04 OUTLIER 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.628 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 . . . . . 0 C--O 1.221 -0.442 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.81 -179.862 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . 0.418 ' C19' HD11 ' A' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . 0.616 ' C7 ' HD11 ' C' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . . . . . . . . . 2.2 mm? . . . . . 0 N--CA 1.489 1.506 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.836 HD13 ' NE1' ' C' ' 666' ' ' TRP . 7.2 tt 55.4 104.23 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.954 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -139.97 161.38 37.74 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.39 179.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.833 HD13 ' H ' ' A' ' 664' ' ' ASP . 0.0 OUTLIER -62.26 -37.76 86.68 Favored 'General case' 0 C--O 1.216 -0.661 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.128 -179.701 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . 0.833 ' H ' HD13 ' A' ' 663' ' ' LEU . 37.3 m-20 -74.84 -26.47 59.71 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.595 178.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.07 -46.07 85.94 Favored 'General case' 0 C--O 1.219 -0.511 0 N-CA-C 112.043 0.386 . . . . 0.0 112.043 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 92.0 m95 -65.17 -48.27 74.08 Favored 'General case' 0 C--O 1.22 -0.483 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.052 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -56.32 -28.67 59.65 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.756 -179.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.3 t -62.15 -31.91 72.45 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.165 179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 10.9 mp -72.28 -14.26 61.71 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m0 -68.61 -25.07 64.67 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.608 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 37.9 t-20 -62.55 -36.42 82.58 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 1.5 m95 -83.36 -22.89 32.69 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 120.497 -0.481 . . . . 0.0 111.334 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 67.89 -40.13 0.41 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 113.263 0.838 . . . . 0.0 113.263 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -62.04 -52.34 64.32 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.475 HD12 ' CE3' ' A' ' 678' ' ' TRP . 7.1 tp -68.16 -38.47 79.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 119.872 -0.731 . . . . 0.0 111.048 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 7.0 m -61.87 -44.43 96.84 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 119.933 -0.707 . . . . 0.0 109.579 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -65.52 -37.68 87.45 Favored 'General case' 0 C--O 1.214 -0.787 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.207 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.475 ' CE3' HD12 ' A' ' 675' ' ' ILE . 7.5 t90 -70.72 -34.5 71.98 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.47 HD23 HG13 ' A' ' 675' ' ' ILE . 1.4 mm? -67.64 -3.42 8.96 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 120.468 -0.493 . . . . 0.0 111.456 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -135.98 150.69 49.35 Favored 'General case' 0 C--O 1.211 -0.966 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 178.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 84.08 -23.0 0.19 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.453 0.701 . . . . 0.0 110.473 -178.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.471 HD13 ' HD1' ' A' ' 678' ' ' TRP . 1.4 tp -67.62 -42.93 87.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 178.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 21.2 ttp-105 -60.59 -48.07 83.38 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 178.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.468 ' HA ' HD12 ' A' ' 687' ' ' ILE . 1.5 mp -59.83 -38.03 74.36 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.989 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.13 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.425 ' HA ' HD12 ' A' ' 688' ' ' ILE . 9.0 t80 -52.7 -43.28 65.51 Favored 'General case' 0 C--O 1.22 -0.481 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.527 -178.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.406 HD12 ' N ' ' A' ' 686' ' ' ILE . 1.8 mp -58.29 -37.89 65.74 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.835 0 C-N-CA 120.298 -0.561 . . . . 0.0 109.9 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . 0.468 HD12 ' HA ' ' A' ' 684' ' ' ILE . 81.2 mt -58.17 -43.8 86.35 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 179.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 685' ' ' PHE . 61.2 mt -58.32 -41.43 81.22 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.513 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 177.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.466 HG12 ' O ' ' A' ' 689' ' ' VAL . 43.5 t -67.74 -3.09 2.06 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 C-N-CA 120.721 -0.391 . . . . 0.0 111.348 -179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -86.29 -53.83 2.86 Favored Glycine 0 C--N 1.349 1.277 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 178.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 15.9 m -61.36 -20.62 63.21 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.735 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.7 tp -54.04 -46.91 72.03 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.593 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.418 HG21 ' HB ' ' B' ' 693' ' ' ILE . 2.1 pp -55.97 -41.21 66.89 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 119.838 -0.745 . . . . 0.0 110.867 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -63.84 -51.62 52.11 Favored Glycine 0 C--O 1.214 -1.098 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.572 ' O ' HG12 ' A' ' 698' ' ' VAL . 1.2 tt -60.08 -34.23 73.16 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.993 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.519 ' NE ' HD13 ' C' ' 697' ' ' ILE . 37.9 mmt180 -65.35 -36.41 83.94 Favored 'General case' 0 C--O 1.214 -0.786 0 N-CA-C 114.873 1.434 . . . . 0.0 114.873 -178.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 4.9 pt -58.98 -40.41 80.47 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 CA-C-N 119.708 1.14 . . . . 0.0 112.352 -177.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.824 ' O ' HG22 ' A' ' 701' ' ' VAL . 5.2 p -55.59 -26.79 20.32 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.915 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.33 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -54.27 -33.88 59.62 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.28 -35.53 62.67 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 119.042 -0.504 . . . . 0.0 111.968 -176.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.824 HG22 ' O ' ' A' ' 698' ' ' VAL . 32.9 m -61.09 -31.92 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.481 178.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -24.39 63.93 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.551 179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 33.9 m -57.45 -43.11 83.66 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.919 -178.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 8.2 tp -70.24 -36.45 74.49 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.122 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 56.9 t -60.68 -35.7 65.74 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.568 -179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -60.94 -21.29 63.28 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.662 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.42 ' HD3' HD21 ' C' ' 704' ' ' LEU . 45.1 mtp85 -101.92 -22.5 14.31 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.435 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.522 ' O ' HG12 ' A' ' 708' ' ' VAL . 17.0 t -108.67 26.15 2.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 120.791 -0.364 . . . . 0.0 110.552 -179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.42 -23.85 52.01 Favored 'General case' 0 C--O 1.219 -0.518 0 C-N-CA 120.636 -0.426 . . . . 0.0 111.474 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 . . . . . 0 C--O 1.22 -0.474 0 CA-C-O 117.99 -1.005 . . . . 0.0 110.706 -179.917 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.529 HD12 HD23 ' A' ' 663' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.484 1.234 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 65.6 mt -137.47 124.3 21.25 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.498 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -151.26 176.51 11.15 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.581 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.604 HD22 ' C ' ' B' ' 663' ' ' LEU . 0.0 OUTLIER -52.19 -18.19 1.4 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 116.059 -0.518 . . . . 0.0 111.945 179.846 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . 0.458 ' N ' HD22 ' B' ' 663' ' ' LEU . 2.2 m-20 -74.51 -47.97 29.93 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.243 178.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -70.24 -38.59 75.21 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.101 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 71.8 m95 -64.96 -37.12 86.61 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.015 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -58.86 -46.0 88.81 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 120.317 -0.553 . . . . 0.0 111.171 -179.035 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 1.9 t -59.76 -31.75 69.94 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.068 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.37 -26.36 52.67 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.216 -0.447 . . . . 0.0 112.174 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . 0.49 ' CE3' HG21 ' B' ' 676' ' ' THR . 98.2 m95 -68.77 -2.86 10.35 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 119.592 -0.843 . . . . 0.0 112.007 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 23.5 m120 -75.71 -19.09 59.34 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 120.354 -0.539 . . . . 0.0 111.619 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 5.5 m95 -102.98 -23.2 13.72 Favored 'General case' 0 C--O 1.211 -0.935 0 C-N-CA 120.166 -0.614 . . . . 0.0 111.557 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 64.07 -59.13 0.2 Allowed 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -51.0 -52.39 43.37 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -177.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.535 HD12 ' CE3' ' B' ' 678' ' ' TRP . 6.5 tp -68.21 -35.52 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 C-N-CA 120.308 -0.557 . . . . 0.0 111.237 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . 0.49 HG21 ' CE3' ' B' ' 670' ' ' TRP . 15.2 m -62.3 -44.75 95.79 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.319 -0.552 . . . . 0.0 110.689 -179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -66.3 -46.94 75.22 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.874 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.535 ' CE3' HD12 ' B' ' 675' ' ' ILE . 1.1 t90 -64.47 -38.68 91.87 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.534 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 8.3 tp -74.27 -20.19 60.23 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -178.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -109.4 9.22 25.62 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 120.573 -0.451 . . . . 0.0 112.006 -179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -123.53 0.5 8.81 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 120.588 -0.445 . . . . 0.0 111.065 178.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.5 HG12 HD11 ' B' ' 686' ' ' ILE . 11.3 tt -68.24 -37.78 78.57 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 CA-C-N 116.819 -0.173 . . . . 0.0 111.31 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -56.16 -46.62 79.23 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.489 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 78.2 mt -68.07 -38.12 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.332 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.482 ' HA ' HD12 ' B' ' 688' ' ' ILE . 60.3 t80 -64.78 -40.63 95.58 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.918 -0.313 . . . . 0.0 110.971 -179.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.5 HD11 HG12 ' B' ' 682' ' ' ILE . 48.2 mt -61.84 -42.29 94.01 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.934 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 53.6 mt -59.49 -41.76 85.73 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 C-N-CA 120.088 -0.645 . . . . 0.0 109.479 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . 0.482 HD12 ' HA ' ' B' ' 685' ' ' PHE . 79.0 mt -56.69 -41.24 74.01 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 28.1 t -67.35 -28.81 43.61 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.806 0 C-N-CA 120.222 -0.591 . . . . 0.0 111.706 -177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -55.38 -26.32 43.96 Favored Glycine 0 CA--C 1.539 1.575 0 C-N-CA 119.946 -1.121 . . . . 0.0 110.832 178.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 16.7 m -88.1 -30.21 20.03 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 116.783 0.292 . . . . 0.0 111.351 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.72 -32.56 52.45 Favored 'General case' 0 C--O 1.215 -0.76 0 CA-C-O 120.635 0.255 . . . . 0.0 110.618 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.667 ' O ' HD12 ' B' ' 693' ' ' ILE . 0.6 OUTLIER -76.0 -27.73 18.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.892 -179.674 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -64.76 -55.71 20.89 Favored Glycine 0 CA--C 1.539 1.562 0 C-N-CA 119.383 -1.389 . . . . 0.0 113.743 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.639 HD22 ' N ' ' B' ' 696' ' ' ARG . 0.0 OUTLIER -62.62 -29.89 70.95 Favored 'General case' 0 CA--C 1.553 1.084 0 CA-C-N 118.138 0.969 . . . . 0.0 113.314 -178.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.639 ' N ' HD22 ' B' ' 695' ' ' LEU . 14.4 mmt180 -49.38 -30.4 7.74 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.725 HD13 ' NH1' ' C' ' 696' ' ' ARG . 43.3 pt -58.35 -38.77 71.29 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 118.102 0.41 . . . . 0.0 110.796 -178.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.49 HG12 ' O ' ' B' ' 695' ' ' LEU . 3.9 p -54.53 -27.46 17.72 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.37 -177.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 18.6 m-85 -54.9 -26.65 37.27 Favored 'General case' 0 C--O 1.214 -0.77 0 C-N-CA 120.305 -0.558 . . . . 0.0 110.796 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -52.67 -35.64 55.55 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 177.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 53.3 t -59.65 -31.34 46.81 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.54 179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 34.1 tp -58.22 -33.89 69.82 Favored 'General case' 0 C--O 1.217 -0.652 0 C-N-CA 121.182 -0.207 . . . . 0.0 110.505 -179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 7.9 m -58.24 -31.8 67.73 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . 0.516 HD12 ' N ' ' B' ' 704' ' ' LEU . 6.4 mp -77.63 -43.15 32.38 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 33.5 m -93.0 -10.66 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 N-CA-C 112.768 0.655 . . . . 0.0 112.768 -178.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -60.74 -34.11 73.93 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 120.076 -0.65 . . . . 0.0 110.439 179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.23 -0.73 52.77 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 61.3 t -84.1 -36.05 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 C-N-CA 120.594 -0.443 . . . . 0.0 110.062 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 17.6 ptm180 -164.95 23.01 0.06 Allowed 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 120.864 -0.334 . . . . 0.0 111.44 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 . . . . . 0 N--CA 1.475 0.783 0 CA-C-O 118.305 -0.855 . . . . 0.0 112.394 179.86 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.511 ' N ' HD23 ' C' ' 660' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.56 HD23 ' CG ' ' C' ' 665' ' ' LYS . 0.2 OUTLIER -169.25 -38.94 0.02 OUTLIER 'General case' 0 C--O 1.21 -0.975 0 CA-C-N 115.844 -0.617 . . . . 0.0 109.942 -178.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . 0.482 ' HG2' ' H ' ' C' ' 665' ' ' LYS . 0.8 OUTLIER 94.38 148.48 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 123.976 0.91 . . . . 0.0 109.476 -179.282 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 9.3 tt -52.34 -40.35 61.82 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -176.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -67.05 -39.58 86.93 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.353 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . 0.56 ' CG ' HD23 ' C' ' 661' ' ' LEU . 1.8 tptt -70.68 -43.5 68.95 Favored 'General case' 0 C--O 1.217 -0.609 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.03 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . 0.836 ' NE1' HD13 ' A' ' 661' ' ' LEU . 64.6 m95 -58.85 -48.46 81.28 Favored 'General case' 0 C--O 1.218 -0.595 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.06 -47.32 85.19 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.458 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 2.5 m -61.54 -31.83 71.87 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.337 178.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.516 HD12 ' C17' ' C' ' 801' ' ' QOJ . 8.8 tp -56.0 -11.51 1.1 Allowed 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -68.68 -18.86 64.34 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -63.87 -44.8 91.99 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -178.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . 0.487 ' HB2' HG22 ' C' ' 675' ' ' ILE . 14.1 m95 -79.96 -22.79 42.21 Favored 'General case' 0 CA--C 1.553 1.062 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 65.89 -68.93 0.12 Allowed 'General case' 0 N--CA 1.479 1.007 0 CA-C-N 119.976 1.262 . . . . 0.0 112.435 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -52.15 -51.88 55.21 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -178.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.541 HG13 HD23 ' C' ' 679' ' ' LEU . 8.8 tp -67.24 -28.96 44.29 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.961 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 22.4 m -58.94 -48.6 80.91 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.976 179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -68.8 -43.94 74.61 Favored 'General case' 0 C--O 1.212 -0.873 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.476 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.49 ' O ' HG23 ' C' ' 682' ' ' ILE . 19.9 t90 -63.49 -19.65 64.93 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . 0.541 HD23 HG13 ' C' ' 675' ' ' ILE . 1.2 mm? -88.97 -2.62 58.67 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.448 -179.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -134.75 -41.33 0.77 Allowed 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 120.291 -0.563 . . . . 0.0 111.83 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -62.59 -18.1 61.46 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.49 HG23 ' O ' ' C' ' 678' ' ' TRP . 0.2 OUTLIER -56.11 -36.81 46.6 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 119.447 -0.901 . . . . 0.0 110.268 179.782 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -62.82 -40.2 96.65 Favored 'General case' 0 C--O 1.218 -0.587 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 38.1 mm -61.68 -46.91 95.53 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.561 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -67.45 -28.46 67.9 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.409 179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -58.36 -43.58 86.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 21.7 mm -67.33 -42.08 87.17 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.581 0 C-N-CA 120.324 -0.551 . . . . 0.0 109.665 179.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . . . . . . . . . 95.9 mt -60.69 -41.32 87.82 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.69 -178.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.605 ' O ' HD12 ' C' ' 692' ' ' LEU . 17.2 m -67.45 -10.95 13.23 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.75 0 C-N-CA 119.119 -1.033 . . . . 0.0 112.934 -176.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -91.56 -8.47 63.95 Favored Glycine 0 CA--C 1.559 2.821 0 C-N-CA 120.055 -1.069 . . . . 0.0 114.424 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 75.5 m -88.81 -34.31 17.1 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 119.322 1.561 . . . . 0.0 112.847 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . 0.838 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -53.73 -31.86 49.92 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.755 -178.15 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.838 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.2 OUTLIER -64.92 -34.76 72.65 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.819 0 C-N-CA 121.435 -0.106 . . . . 0.0 111.068 -179.539 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.9 -55.38 31.22 Favored Glycine 0 CA--C 1.536 1.376 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.611 -179.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.488 ' C ' HD23 ' C' ' 695' ' ' LEU . 8.6 tt -60.72 -46.34 90.78 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -178.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.725 ' NH1' HD13 ' B' ' 697' ' ' ILE . 66.1 mtp85 -55.28 -35.78 65.41 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.565 HD11 HD12 ' C' ' 693' ' ' ILE . 68.2 mt -59.23 -41.59 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.497 ' O ' HG22 ' C' ' 701' ' ' VAL . 53.4 t -56.57 -28.09 26.5 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.992 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.209 179.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . 0.579 ' HA ' HD11 ' C' ' 702' ' ' LEU . 4.5 t80 -55.34 -34.94 64.67 Favored 'General case' 0 C--O 1.206 -1.232 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -178.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.99 -36.04 78.39 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -176.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . 0.497 HG22 ' O ' ' C' ' 698' ' ' VAL . 16.6 m -67.79 -39.68 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 N-CA-C 113.981 1.104 . . . . 0.0 113.981 -176.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . 0.714 HD13 ' H ' ' C' ' 702' ' ' LEU . 0.0 OUTLIER -65.83 -24.12 66.83 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 118.431 -1.308 . . . . 0.0 111.617 -178.821 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . 0.569 ' N ' HD22 ' C' ' 702' ' ' LEU . 57.3 m -59.19 -40.63 86.32 Favored 'General case' 0 C--O 1.219 -0.503 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 179.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . 0.42 HD21 ' HD3' ' A' ' 707' ' ' ARG . 15.7 tp -59.06 -27.08 65.19 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 120.295 -0.562 . . . . 0.0 109.911 178.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 12.3 t -74.27 -26.74 20.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.976 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 29.6 t30 -60.87 -9.43 4.13 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 5.9 mtt-85 -90.64 -23.91 20.65 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.307 179.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 49.9 t -91.98 -35.99 7.42 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.548 0 C-N-CA 120.921 -0.311 . . . . 0.0 110.254 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 65.2 ttp85 -100.74 67.2 1.24 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.123 0.487 . . . . 0.0 110.607 -179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 . . . . . 0 C--O 1.22 -0.465 0 CA-C-O 117.787 -1.101 . . . . 0.0 111.18 179.939 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . 0.549 ' C31' HD12 ' A' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . 0.516 ' C17' HD12 ' C' ' 669' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.516 ' HG ' ' HB2' ' C' ' 667' ' ' ALA . 4.2 mm? . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.482 ' O ' HD12 ' C' ' 663' ' ' LEU . 1.9 mm? -122.86 146.81 47.24 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 179.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -157.97 170.16 22.95 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.14 -0.624 . . . . 0.0 111.368 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.572 HD21 ' CD2' ' B' ' 660' ' ' LEU . 4.6 tt -61.76 -40.37 94.92 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.386 179.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -71.27 -26.63 62.97 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.104 -179.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 33.8 mtpt -70.17 -43.87 69.93 Favored 'General case' 0 C--O 1.22 -0.467 0 C-N-CA 120.692 -0.403 . . . . 0.0 111.567 -179.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . 0.475 ' NE1' HD12 ' A' ' 661' ' ' LEU . 89.8 m95 -66.83 -47.98 70.33 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.586 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -59.36 -30.79 68.66 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 120.471 -0.492 . . . . 0.0 111.01 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.2 t -58.12 -32.47 68.16 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.249 179.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 25.0 mt -60.01 -11.92 6.89 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.596 179.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 16.1 m95 -67.93 -42.2 81.39 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.8 -0.76 . . . . 0.0 109.855 -179.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -63.72 -15.4 58.42 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.856 177.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . 0.556 ' O ' ' N ' ' A' ' 674' ' ' ASP . 93.4 m95 -103.19 16.91 25.34 Favored 'General case' 0 C--O 1.21 -0.99 0 CA-C-O 118.742 -0.647 . . . . 0.0 111.776 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -7.24 -49.91 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 115.47 1.655 . . . . 0.0 115.47 -178.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . 0.556 ' N ' ' O ' ' A' ' 672' ' ' TRP . 25.8 t70 -50.8 -52.34 41.96 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 119.175 -0.44 . . . . 0.0 111.459 179.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.518 HG22 ' HB3' ' A' ' 672' ' ' TRP . 8.5 tp -68.65 -30.74 48.29 Favored 'Isoleucine or valine' 0 C--N 1.354 0.779 0 C-N-CA 119.477 -0.889 . . . . 0.0 111.131 179.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 11.4 m -59.2 -44.49 92.25 Favored 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 58.4 m-80 -60.4 -44.18 95.95 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 178.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.475 ' CE3' HD11 ' A' ' 675' ' ' ILE . 54.6 t90 -58.15 -34.86 70.75 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.153 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 53.5 mt -84.6 -2.82 57.99 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -136.29 7.81 3.13 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -179.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -129.52 -27.62 2.37 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 120.197 -0.601 . . . . 0.0 111.769 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.4 HG22 ' O ' ' A' ' 678' ' ' TRP . 16.6 tt -61.49 -37.73 78.47 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.149 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 34.4 ttp-105 -55.75 -48.38 75.34 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 120.292 -0.563 . . . . 0.0 109.489 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.439 HD12 ' N ' ' A' ' 684' ' ' ILE . 1.8 mp -60.68 -45.93 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.928 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -52.78 -40.91 63.62 Favored 'General case' 0 C--O 1.218 -0.564 0 C-N-CA 121.219 -0.192 . . . . 0.0 111.335 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.546 ' CG1' HG21 ' C' ' 686' ' ' ILE . 1.3 mp -58.16 -38.04 65.79 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.099 0 CA-C-O 119.24 -0.41 . . . . 0.0 110.544 -179.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.37 -43.26 86.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.198 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . 0.615 ' H ' HD12 ' A' ' 688' ' ' ILE . 4.0 mp -62.27 -41.46 91.58 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.564 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.614 ' O ' HD11 ' A' ' 692' ' ' LEU . 46.7 t -68.49 3.74 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.208 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . 0.417 ' O ' HG22 ' A' ' 693' ' ' ILE . . . -109.31 -9.86 24.83 Favored Glycine 0 CA--C 1.545 1.911 0 C-N-CA 120.911 -0.661 . . . . 0.0 111.492 178.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 3.7 m -88.17 -28.66 21.07 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 117.098 0.449 . . . . 0.0 112.051 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.614 HD11 ' O ' ' A' ' 689' ' ' VAL . 0.2 OUTLIER -53.51 -32.32 49.94 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.335 -178.299 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.592 HD11 ' HG2' ' B' ' 696' ' ' ARG . 4.8 tp -53.88 -39.56 40.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.569 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -70.57 -36.97 68.37 Favored Glycine 0 CA--C 1.532 1.139 0 N-CA-C 109.117 -1.593 . . . . 0.0 109.117 177.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.572 ' O ' HG12 ' A' ' 698' ' ' VAL . 0.4 OUTLIER -56.65 -31.85 64.77 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 115.533 -0.334 . . . . 0.0 110.962 179.343 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.514 ' HG3' HD11 ' C' ' 693' ' ' ILE . 30.1 mmt180 -61.61 -35.92 79.26 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 61.1 mt -59.15 -41.38 83.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 CA-C-O 118.973 -0.537 . . . . 0.0 112.092 -176.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.648 ' O ' HG12 ' A' ' 701' ' ' VAL . 5.3 p -56.76 -29.09 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 CA-C-N 118.865 0.757 . . . . 0.0 111.473 -179.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -55.68 -35.37 65.94 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.242 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.39 -35.41 65.28 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.383 -178.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.648 HG12 ' O ' ' A' ' 698' ' ' VAL . 1.3 p -59.6 -31.67 47.44 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 178.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 11.3 tp -58.64 -24.53 61.33 Favored 'General case' 0 C--O 1.215 -0.712 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.796 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 68.4 m -57.57 -43.24 84.4 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.396 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 17.3 tp -62.45 -42.93 99.82 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 178.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.57 -34.17 66.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.19 178.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -67.27 -32.14 72.95 Favored 'General case' 0 C--O 1.22 -0.483 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.584 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 79.3 mtt180 -73.94 -22.2 59.75 Favored 'General case' 0 C--O 1.219 -0.506 0 C-N-CA 120.697 -0.401 . . . . 0.0 111.556 -179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 59.6 t -82.97 -36.18 12.82 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.496 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.127 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -142.79 -76.34 0.26 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.374 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 63.8 tp60 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.607 179.725 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.572 ' CD2' HD21 ' A' ' 663' ' ' LEU . 4.3 mp . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -126.81 136.96 53.08 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.597 -179.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -149.82 175.38 11.68 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 123.34 0.4 . . . . 0.0 110.797 -179.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.462 HD23 ' N ' ' B' ' 664' ' ' ASP . 0.2 OUTLIER -64.77 -40.22 94.91 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.792 178.447 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . 0.462 ' N ' HD23 ' B' ' 663' ' ' LEU . 4.4 p-10 -68.97 -26.33 64.98 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.595 -0.73 . . . . 0.0 111.867 -179.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 4.0 tttm -68.85 -41.45 78.44 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.318 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 91.2 m95 -72.93 -53.58 10.92 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.297 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . 0.518 ' HB2' HD12 ' C' ' 660' ' ' LEU . . . -56.31 -25.84 50.08 Favored 'General case' 0 C--O 1.217 -0.654 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.704 -179.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 53.6 p -58.62 -31.84 68.46 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.626 -0.43 . . . . 0.0 110.898 179.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.774 HD22 HG21 ' B' ' 675' ' ' ILE . 67.8 mt -71.84 -15.07 62.13 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 18.7 m95 -69.08 -2.4 10.04 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -74.36 -48.16 29.78 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.029 -0.669 . . . . 0.0 110.696 -178.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 6.7 p90 -103.3 -22.49 13.69 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.131 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 60.02 2.25 0.39 Allowed 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.3 -52.97 59.76 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 118.283 0.492 . . . . 0.0 111.435 -179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.774 HG21 HD22 ' B' ' 669' ' ' LEU . 6.8 tp -68.21 -31.46 51.71 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.619 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.073 179.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.1 m -59.2 -43.21 92.24 Favored 'General case' 0 C--O 1.219 -0.526 0 C-N-CA 120.417 -0.513 . . . . 0.0 110.449 -179.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -67.28 -38.58 85.3 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.377 -179.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.787 ' O ' HG23 ' B' ' 682' ' ' ILE . 5.9 t90 -72.15 -46.25 57.23 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 120.8 -0.36 . . . . 0.0 111.635 -179.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.429 HD12 HG13 ' B' ' 675' ' ' ILE . 14.6 mt -75.33 -33.14 61.1 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 5.0 t90 -84.74 10.46 11.32 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 119.947 -0.701 . . . . 0.0 112.41 -178.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -128.96 -5.55 5.03 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 120.759 -0.377 . . . . 0.0 111.98 179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.787 HG23 ' O ' ' B' ' 678' ' ' TRP . 2.2 pp -67.74 -43.14 86.66 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.713 0 C-N-CA 120.562 -0.455 . . . . 0.0 111.519 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 19.1 mtp-105 -55.88 -47.89 76.55 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.186 -179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 84.3 mt -67.91 -38.48 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.389 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -55.26 -37.91 67.87 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 121.06 -0.256 . . . . 0.0 111.61 -178.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.943 HG21 HD12 ' C' ' 686' ' ' ILE . 16.2 mm -60.99 -40.81 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.034 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 59.4 mt -58.87 -41.57 83.24 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . . . . . . . . . 32.1 mm -57.51 -42.84 81.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.501 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 48.6 t -68.57 -8.65 10.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.554 -179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -82.51 -37.87 13.46 Favored Glycine 0 C--N 1.349 1.259 0 N-CA-C 110.614 -0.994 . . . . 0.0 110.614 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.64 -27.59 62.23 Favored 'General case' 0 C--O 1.218 -0.57 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.825 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.13 -54.59 43.31 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.596 -0.275 . . . . 0.0 110.518 -179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.704 HD11 ' HD3' ' C' ' 696' ' ' ARG . 0.7 OUTLIER -55.57 -28.73 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.917 -179.266 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . 0.526 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -67.35 -50.49 44.18 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 119.46 -1.352 . . . . 0.0 111.235 -179.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.495 ' O ' HG12 ' B' ' 698' ' ' VAL . 2.1 mt -56.76 -31.83 65.0 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.592 ' HG2' HD11 ' A' ' 693' ' ' ILE . 0.6 OUTLIER -50.59 -30.66 13.83 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -179.249 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.526 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.1 tp -58.78 -41.04 81.46 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 -176.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.495 HG12 ' O ' ' B' ' 695' ' ' LEU . 9.2 p -56.13 -28.11 24.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 CA-C-N 118.279 0.491 . . . . 0.0 111.517 -179.345 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -55.25 -26.84 42.37 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.549 -0.46 . . . . 0.0 111.587 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.48 -36.24 66.39 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 120.402 -0.519 . . . . 0.0 109.832 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 77.9 t -64.82 -41.34 91.92 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . 0.425 HD23 ' C ' ' B' ' 702' ' ' LEU . 10.4 tt -61.13 -38.34 86.03 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.476 179.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 24.3 p -59.6 -32.66 70.6 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.273 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 20.2 tp -63.91 -42.33 97.44 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.103 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 59.8 t -63.1 -18.99 22.64 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.766 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.954 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -62.41 -34.05 75.98 Favored 'General case' 0 C--O 1.218 -0.566 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.84 179.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -73.81 -26.59 60.7 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.546 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 47.2 t -82.85 -36.12 12.9 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.505 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.336 -179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 29.1 ttt85 -150.36 -67.35 0.2 Allowed 'General case' 0 C--O 1.219 -0.543 0 C-N-CA 120.625 -0.43 . . . . 0.0 110.824 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.419 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.518 HD12 ' HB2' ' B' ' 667' ' ' ALA . 2.1 tt . . . . . 0 N--CA 1.487 1.384 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.426 HD23 ' C8 ' ' C' ' 801' ' ' QOJ . 0.2 OUTLIER -117.42 -160.67 0.78 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 178.669 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -147.79 141.93 26.08 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 119.884 -0.726 . . . . 0.0 110.897 179.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.495 HD23 ' C ' ' C' ' 663' ' ' LEU . 9.7 tt -61.33 -40.17 93.22 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.924 179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -74.06 -25.7 59.98 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.868 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 22.2 mtpp -67.21 -39.83 86.35 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.974 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 72.7 m95 -62.25 -50.35 72.07 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . 0.516 ' HB2' ' HG ' ' A' ' 660' ' ' LEU . . . -66.55 -35.62 80.68 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.299 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 59.7 p -57.73 -31.93 66.93 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.073 -179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 62.7 mt -60.71 -10.1 4.89 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 120.354 -0.538 . . . . 0.0 111.991 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 15.3 m95 -68.73 -13.24 62.26 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.877 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -62.82 -44.68 95.52 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.981 -179.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -79.8 -12.8 59.75 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 119.638 -0.825 . . . . 0.0 113.146 -177.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 3.3 t80 69.17 -63.99 0.35 Allowed 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 119.734 1.152 . . . . 0.0 112.286 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -57.21 -37.56 72.39 Favored 'General case' 0 C--O 1.218 -0.588 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.508 HD12 ' CE3' ' C' ' 678' ' ' TRP . 8.5 tp -67.73 -37.2 78.19 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.549 0 C-N-CA 120.228 -0.589 . . . . 0.0 110.885 -179.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 4.4 m -60.97 -49.52 77.12 Favored 'General case' 0 C--O 1.22 -0.487 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.272 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 -70.0 -45.07 68.06 Favored 'General case' 0 C--O 1.216 -0.683 0 C-N-CA 120.43 -0.508 . . . . 0.0 109.634 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.508 ' CE3' HD12 ' C' ' 675' ' ' ILE . 20.2 t90 -55.89 -23.21 29.94 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.297 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 48.2 mt -94.12 -25.48 17.13 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 120.448 -0.501 . . . . 0.0 112.148 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -109.27 11.94 25.1 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 -178.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -122.26 -28.01 4.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.613 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 2.2 pp -61.2 -41.7 90.55 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.759 0 C-N-CA 120.466 -0.493 . . . . 0.0 111.582 -179.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 31.7 ttp-105 -58.47 -48.29 81.24 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.429 -0.508 . . . . 0.0 111.119 -179.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 78.8 mt -67.67 -43.28 86.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.616 ' HA ' HD12 ' C' ' 688' ' ' ILE . 2.3 m-85 -52.82 -28.18 21.57 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.902 -178.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.943 HD12 HG21 ' B' ' 686' ' ' ILE . 20.8 mm -58.25 -38.05 66.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.041 -178.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 77.5 mt -61.3 -42.0 91.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' C' ' 685' ' ' PHE . 68.5 mt -63.49 -41.16 91.7 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.73 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . 0.612 ' O ' HD12 ' C' ' 692' ' ' LEU . 90.2 t -67.18 -26.15 35.66 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.043 0 CA-C-O 118.578 -0.725 . . . . 0.0 112.412 -176.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -83.94 2.86 87.03 Favored Glycine 0 CA--C 1.55 2.225 0 C-N-CA 119.855 -1.164 . . . . 0.0 113.046 -179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 67.6 m -88.98 -34.57 16.8 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 118.657 1.229 . . . . 0.0 112.603 -179.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . 0.892 HD13 ' N ' ' C' ' 693' ' ' ILE . 0.0 OUTLIER -68.7 -31.93 71.37 Favored 'General case' 0 C--O 1.22 -0.492 0 C-N-CA 120.766 -0.374 . . . . 0.0 111.592 -178.47 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.892 ' N ' HD13 ' C' ' 692' ' ' LEU . 0.1 OUTLIER -63.08 -32.39 56.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 178.803 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.81 -41.34 99.61 Favored Glycine 0 CA--C 1.542 1.727 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.495 178.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.67 ' O ' HG22 ' C' ' 698' ' ' VAL . 0.3 OUTLIER -56.41 -31.47 63.92 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 117.351 0.575 . . . . 0.0 112.389 -179.148 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.704 ' HD3' HD11 ' B' ' 693' ' ' ILE . 0.9 OUTLIER -50.71 -36.18 34.93 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 114.296 1.221 . . . . 0.0 114.296 -178.375 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 1.3 pt -59.4 -41.39 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 CA-C-N 119.273 0.942 . . . . 0.0 113.311 -176.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.725 ' O ' HG12 ' C' ' 701' ' ' VAL . 5.2 m -56.41 -27.77 25.2 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.838 0 C-N-CA 119.088 -1.045 . . . . 0.0 111.541 -178.489 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -54.84 -35.43 63.97 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.838 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.67 66.45 Favored 'General case' 0 C--O 1.219 -0.519 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.952 -179.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . 0.725 HG12 ' O ' ' C' ' 698' ' ' VAL . 2.7 p -59.74 -31.48 47.31 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.961 178.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 15.7 tp -58.38 -26.2 62.93 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.746 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 2.3 m -58.56 -39.28 79.82 Favored 'General case' 0 C--O 1.219 -0.524 0 C-N-CA 120.585 -0.446 . . . . 0.0 110.054 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 15.5 tp -59.55 -39.47 84.1 Favored 'General case' 0 C--O 1.218 -0.568 0 N-CA-C 109.584 -0.525 . . . . 0.0 109.584 178.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 12.8 t -76.1 -16.79 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.156 179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -60.63 -28.24 68.4 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 111.808 0.299 . . . . 0.0 111.808 -179.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 34.9 ptt85 -78.66 -24.28 45.24 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 120.612 -0.435 . . . . 0.0 111.53 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . 0.527 ' O ' HG12 ' C' ' 708' ' ' VAL . 18.6 t -100.23 26.24 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-O 120.661 0.267 . . . . 0.0 110.795 -179.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 84.4 mtt-85 -53.37 129.35 31.68 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.744 -0.382 . . . . 0.0 110.867 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.06 -0.971 . . . . 0.0 110.625 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . 0.426 ' C8 ' HD23 ' C' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.443 ' N ' HD11 ' C' ' 663' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.702 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . . . . . . . . . 45.0 mt -132.5 -73.52 0.51 Allowed 'General case' 0 C--O 1.213 -0.816 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.52 179.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 69.33 147.52 0.06 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 120.642 0.258 . . . . 0.0 111.034 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . 0.586 ' C ' HD22 ' A' ' 663' ' ' LEU . 0.0 OUTLIER -53.56 -17.59 2.21 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.851 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -73.86 -37.13 64.87 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.042 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 13.6 tppt? -70.29 -42.37 72.15 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.23 -0.588 . . . . 0.0 110.391 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -60.36 -50.06 75.12 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.458 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -67.55 -35.99 80.11 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.094 -179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 38.2 m -57.44 -32.49 66.96 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.397 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . . . . . . . . . 51.3 tp -62.61 -14.69 45.83 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.882 179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -68.44 -8.95 45.27 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.117 -0.633 . . . . 0.0 111.576 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 4.9 p30 -62.61 -48.02 81.22 Favored 'General case' 0 C--O 1.218 -0.585 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.183 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -102.47 -23.01 13.96 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 120.43 -0.508 . . . . 0.0 110.016 178.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 7.2 t80 51.8 6.99 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -63.81 -52.81 58.51 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 118.873 0.76 . . . . 0.0 111.534 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.445 ' CG2' HD12 ' A' ' 679' ' ' LEU . 41.0 mm -68.39 -42.39 84.07 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.685 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 1.4 m -62.76 -44.81 95.21 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.233 -178.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -59.95 -46.74 88.43 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.304 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.439 ' CZ2' HD12 ' A' ' 682' ' ' ILE . 7.8 t-105 -71.0 -46.51 62.14 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 120.628 -0.429 . . . . 0.0 112.134 -178.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.445 HD12 ' CG2' ' A' ' 675' ' ' ILE . 96.5 mt -74.79 -11.25 60.11 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -176.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -70.35 -3.47 17.53 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 118.927 -1.109 . . . . 0.0 110.884 178.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -149.44 12.91 0.83 Allowed 'General case' 0 C--N 1.352 0.685 0 C-N-CA 120.244 -0.582 . . . . 0.0 112.22 178.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.439 HD12 ' CZ2' ' A' ' 678' ' ' TRP . 14.9 tt -55.76 -39.63 56.85 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.689 0 CA-C-N 118.841 0.746 . . . . 0.0 109.265 178.274 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 32.9 ptt-85 -70.16 -40.3 74.82 Favored 'General case' 0 C--O 1.219 -0.549 0 C-N-CA 120.495 -0.482 . . . . 0.0 109.779 178.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 31.7 mt -59.73 -42.1 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.63 -37.65 58.82 Favored 'General case' 0 C--O 1.22 -0.493 0 C-N-CA 120.846 -0.342 . . . . 0.0 110.886 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . . . . . . . . . 17.5 mm -58.45 -38.66 71.33 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.504 0 C-N-CA 120.214 -0.594 . . . . 0.0 110.344 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 66.9 mt -58.5 -42.91 85.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 56.4 mt -60.63 -42.91 93.51 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.441 HG12 ' O ' ' A' ' 689' ' ' VAL . 57.7 t -68.5 -2.49 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.21 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.883 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -92.94 -34.04 7.03 Favored Glycine 0 C--N 1.352 1.417 0 N-CA-C 109.966 -1.253 . . . . 0.0 109.966 178.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 56.8 m -80.36 -24.87 39.52 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 178.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.3 tp -58.42 -42.62 87.63 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.224 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . . . . . . . . . 3.5 tp -65.3 -28.07 43.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.52 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . 0.604 ' O ' HG22 ' A' ' 697' ' ' ILE . . . -69.83 -51.59 23.77 Favored Glycine 0 C--O 1.212 -1.257 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 178.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.41 -31.84 64.28 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-O 120.491 0.186 . . . . 0.0 110.501 179.11 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' A' ' 699' ' ' PHE . 0.1 OUTLIER -56.61 -37.24 70.42 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.601 179.725 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . 0.681 HD11 ' HB3' ' B' ' 699' ' ' PHE . 7.3 tp -60.62 -41.2 87.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 119.722 -0.791 . . . . 0.0 110.406 -179.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.623 ' O ' HG22 ' A' ' 701' ' ' VAL . 2.2 t -56.89 -28.97 29.6 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.632 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 696' ' ' ARG . 13.8 m-85 -58.32 -34.57 70.74 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 178.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.7 -35.72 63.91 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 698' ' ' VAL . 25.1 m -60.62 -36.77 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.766 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 6.2 tt -58.99 -30.5 68.01 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.222 -179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 38.5 t -58.65 -44.97 90.25 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.794 -179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.52 ' O ' HD23 ' A' ' 704' ' ' LEU . 5.3 tt -66.91 -36.07 81.43 Favored 'General case' 0 C--O 1.213 -0.852 0 CA-C-O 120.927 0.394 . . . . 0.0 110.112 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 59.7 t -60.59 -26.87 39.08 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.695 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -62.59 -34.13 76.37 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 112.322 0.489 . . . . 0.0 112.322 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -80.01 -6.2 57.16 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 120.146 -0.622 . . . . 0.0 112.352 -178.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.525 ' O ' HG12 ' A' ' 708' ' ' VAL . 17.1 t -89.28 25.98 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.508 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 11.5 tpp180 -56.63 112.23 1.23 Allowed 'General case' 0 C--O 1.219 -0.503 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.441 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 . . . . . 0 C--O 1.219 -0.54 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.999 -179.821 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 4.6 mp . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . . . . . . . . . 1.2 mt 54.63 97.68 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.598 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.747 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 64.7 mt-10 -151.82 -179.69 7.67 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.016 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 9.9 tt -52.88 -36.15 58.79 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.073 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.05 -37.5 69.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.622 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.06 -46.19 65.5 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 120.608 -0.437 . . . . 0.0 111.72 -179.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 93.4 m95 -62.57 -38.45 90.13 Favored 'General case' 0 C--O 1.217 -0.622 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.59 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . 0.54 ' HB2' HD22 ' C' ' 660' ' ' LEU . . . -72.05 -31.46 66.16 Favored 'General case' 0 C--O 1.217 -0.656 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.082 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 6.9 t -57.37 -32.08 66.43 Favored 'General case' 0 C--O 1.219 -0.548 0 C-N-CA 120.409 -0.516 . . . . 0.0 110.292 179.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.411 ' HG ' ' CH2' ' B' ' 672' ' ' TRP . 5.9 mp -61.0 -15.61 33.68 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.96 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 9.9 m95 -68.66 -2.97 10.33 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 118.965 -0.541 . . . . 0.0 112.405 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -89.04 -49.57 6.68 Favored 'General case' 0 C--N 1.35 0.598 0 C-N-CA 119.208 -0.997 . . . . 0.0 112.935 -178.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . 0.411 ' CH2' ' HG ' ' B' ' 669' ' ' LEU . 4.7 p-90 -104.21 -24.15 13.17 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 119.702 -0.799 . . . . 0.0 111.666 178.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 2.4 t80 47.5 -4.18 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.336 0 N-CA-C 116.951 2.204 . . . . 0.0 116.951 176.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . 0.401 ' N ' ' O ' ' B' ' 672' ' ' TRP . 2.7 m-20 -63.73 -54.39 36.23 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 121.061 1.755 . . . . 0.0 113.053 -177.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.426 HD13 ' HA ' ' B' ' 675' ' ' ILE . 10.7 mm -69.91 -27.59 33.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.837 178.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 34.1 m -58.66 -46.81 86.36 Favored 'General case' 0 C--O 1.22 -0.478 0 C-N-CA 120.486 -0.486 . . . . 0.0 109.7 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -65.49 -31.74 72.97 Favored 'General case' 0 C--O 1.217 -0.653 0 C-N-CA 120.489 -0.484 . . . . 0.0 109.855 178.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.49 ' CZ3' HD21 ' B' ' 679' ' ' LEU . 33.8 t90 -67.38 -45.52 76.0 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.113 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.49 HD21 ' CZ3' ' B' ' 678' ' ' TRP . 64.4 mt -81.12 -23.27 38.46 Favored 'General case' 0 C--O 1.22 -0.464 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -177.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 9.3 t90 -92.53 0.62 57.45 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.83 -0.748 . . . . 0.0 112.385 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -130.23 -1.12 4.56 Favored 'General case' 0 C--O 1.218 -0.603 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.572 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 6.4 tp -65.89 -44.1 92.77 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 C-N-CA 120.512 -0.475 . . . . 0.0 111.664 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.94 -40.03 75.65 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.438 -0.505 . . . . 0.0 111.283 -179.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 92.8 mt -68.17 -43.86 84.63 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.568 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.537 ' HA ' HD13 ' B' ' 688' ' ' ILE . 2.5 m-85 -54.74 -28.4 48.17 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.39 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.493 HG21 HD12 ' C' ' 686' ' ' ILE . 19.0 mm -58.65 -40.36 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 120.789 -0.364 . . . . 0.0 110.921 -178.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 60.7 mt -58.81 -41.63 83.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . 0.537 HD13 ' HA ' ' B' ' 685' ' ' PHE . 3.7 mp -61.94 -41.46 91.0 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.214 179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . . . . . . . . . 46.5 t -67.8 -10.13 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 120.424 -0.51 . . . . 0.0 112.025 -177.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -77.81 -39.99 23.07 Favored Glycine 0 C--N 1.346 1.112 0 N-CA-C 110.479 -1.048 . . . . 0.0 110.479 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 24.2 m -74.07 -17.26 60.98 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.706 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.87 -33.7 68.97 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.27 -179.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.548 HG12 HD13 ' C' ' 692' ' ' LEU . 2.3 pp -70.9 -39.05 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 C-N-CA 120.328 -0.549 . . . . 0.0 110.763 -179.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . 0.551 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -63.41 -42.93 98.94 Favored Glycine 0 C--O 1.217 -0.926 0 N-CA-C 110.593 -1.003 . . . . 0.0 110.593 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.412 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.5 OUTLIER -56.26 -31.4 63.54 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 120.584 0.231 . . . . 0.0 111.088 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.511 ' HE ' HD13 ' A' ' 697' ' ' ILE . 1.0 OUTLIER -50.27 -30.48 11.9 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.795 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.551 HG22 ' O ' ' B' ' 694' ' ' GLY . 7.2 tp -58.9 -40.75 81.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -175.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.412 HG12 ' O ' ' B' ' 695' ' ' LEU . 7.4 p -55.96 -28.74 25.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 CA-C-N 118.912 0.778 . . . . 0.0 111.747 -178.225 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . 0.681 ' HB3' HD11 ' A' ' 697' ' ' ILE . 14.9 m-85 -55.52 -24.17 30.38 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 179.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -48.61 -34.63 11.98 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -177.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 33.3 m -58.66 -31.16 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.23 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 39.1 tp -58.24 -35.76 72.2 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 116.608 -0.269 . . . . 0.0 110.366 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 14.2 m -58.23 -31.89 67.81 Favored 'General case' 0 C--O 1.218 -0.603 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.689 -179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . 0.439 HD22 ' N ' ' B' ' 704' ' ' LEU . 3.9 mm? -68.74 -43.5 75.76 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 120.187 -0.605 . . . . 0.0 112.078 -178.597 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 34.2 m -95.45 -10.3 9.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 42.7 p-10 -60.62 -15.34 27.21 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 119.832 -0.747 . . . . 0.0 111.662 -179.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . 0.521 ' HG3' HG13 ' B' ' 708' ' ' VAL . 21.3 ptt180 -85.89 -34.39 20.99 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 120.489 -0.484 . . . . 0.0 111.189 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.521 HG13 ' HG3' ' B' ' 707' ' ' ARG . 27.8 m -91.4 26.08 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 120.858 -0.337 . . . . 0.0 111.381 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 23.7 mmt180 -50.8 146.61 5.69 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.185 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 . . . . . 0 C--O 1.22 -0.458 0 CA-C-O 117.941 -1.028 . . . . 0.0 110.662 -179.982 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.54 HD22 ' HB2' ' B' ' 667' ' ' ALA . 6.1 mp . . . . . 0 N--CA 1.491 1.609 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . 0.488 HD21 ' CZ2' ' C' ' 666' ' ' TRP . 4.6 tp 53.96 -153.62 0.28 Allowed 'General case' 0 CA--C 1.549 0.94 0 CA-C-O 118.447 -0.787 . . . . 0.0 110.193 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 122.21 168.68 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 125.861 1.664 . . . . 0.0 109.685 -179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.443 HD11 ' N ' ' A' ' 660' ' ' LEU . 10.2 tt -61.08 -40.07 92.31 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.751 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -72.22 -23.83 61.3 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.862 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -69.05 -41.59 77.42 Favored 'General case' 0 C--O 1.219 -0.5 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.844 -178.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . 0.488 ' CZ2' HD21 ' C' ' 661' ' ' LEU . 94.2 m95 -65.37 -44.08 88.74 Favored 'General case' 0 C--O 1.217 -0.634 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.317 -179.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -55.09 -30.67 60.17 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 116.04 -0.527 . . . . 0.0 112.391 -178.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 92.9 p -59.91 -32.79 71.09 Favored 'General case' 0 C--O 1.219 -0.552 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.904 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 32.6 mt -66.59 -6.9 16.93 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 17.9 m95 -77.2 -17.6 58.38 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -62.77 -50.01 72.72 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 119.009 -1.077 . . . . 0.0 110.953 -178.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . 0.411 ' O ' ' N ' ' C' ' 674' ' ' ASP . 7.7 p90 -96.03 -22.88 17.09 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 43.3 p90 45.45 3.21 0.0 OUTLIER 'General case' 0 C--N 1.364 1.206 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 179.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' C' ' 672' ' ' TRP . 7.2 t0 -64.24 -53.63 46.04 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 120.069 1.304 . . . . 0.0 110.463 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 8.4 tp -69.54 -29.23 40.81 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.918 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.357 178.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 19.2 m -58.63 -38.03 77.2 Favored 'General case' 0 C--O 1.22 -0.488 0 O-C-N 123.123 0.264 . . . . 0.0 111.393 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -59.97 -47.08 87.3 Favored 'General case' 0 C--O 1.22 -0.494 0 C-N-CA 120.009 -0.677 . . . . 0.0 109.947 179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.549 ' HD1' HG21 ' C' ' 682' ' ' ILE . 13.1 t90 -72.53 -37.08 68.41 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 116.526 -0.306 . . . . 0.0 111.238 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.4 -2.45 6.29 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.256 0.465 . . . . 0.0 112.256 -178.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 11.5 t90 -142.57 153.31 43.42 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-O 122.083 0.944 . . . . 0.0 112.187 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . 0.475 ' HB2' HD12 ' C' ' 684' ' ' ILE . 5.4 p90 56.98 -3.81 0.04 OUTLIER 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 115.851 1.797 . . . . 0.0 115.851 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.792 HD12 ' N ' ' C' ' 683' ' ' ARG . 2.4 pp -62.98 -34.88 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 119.572 1.078 . . . . 0.0 109.244 176.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . 0.792 ' N ' HD12 ' C' ' 682' ' ' ILE . 19.1 ttp-105 -54.47 -31.17 55.16 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.117 -179.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . 0.475 HD12 ' HB2' ' C' ' 681' ' ' TYR . 89.5 mt -59.49 -48.08 88.5 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.53 0 C-N-CA 120.516 -0.473 . . . . 0.0 109.834 179.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.418 ' HA ' HD13 ' C' ' 688' ' ' ILE . 27.9 m-85 -53.81 -27.96 32.49 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.284 -178.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.493 HD12 HG21 ' B' ' 686' ' ' ILE . 31.4 mm -57.83 -38.09 63.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.942 -177.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 69.1 mt -59.3 -42.11 86.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 178.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.418 HD13 ' HA ' ' C' ' 685' ' ' PHE . 3.8 mp -67.97 -41.56 84.74 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.731 179.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 93.3 t -67.82 -31.09 50.69 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 CA-C-O 118.143 -0.932 . . . . 0.0 112.312 -178.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -77.42 13.45 11.14 Favored Glycine 0 CA--C 1.543 1.81 0 CA-C-N 120.166 1.348 . . . . 0.0 112.24 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 8.9 m -88.69 -34.13 17.32 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 117.797 0.798 . . . . 0.0 111.569 -179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . 0.638 HD12 ' H ' ' C' ' 693' ' ' ILE . 0.2 OUTLIER -53.86 -32.46 53.2 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.416 -179.731 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.638 ' H ' HD12 ' C' ' 692' ' ' LEU . 0.2 OUTLIER -55.14 -37.78 44.33 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 C-N-CA 120.259 -0.576 . . . . 0.0 109.584 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -59.28 -42.52 97.36 Favored Glycine 0 CA--C 1.537 1.419 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 177.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.689 ' O ' HG22 ' C' ' 698' ' ' VAL . 0.3 OUTLIER -56.46 -30.46 62.92 Favored 'General case' 0 CA--C 1.551 1.019 0 N-CA-C 111.624 0.231 . . . . 0.0 111.624 179.534 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -49.75 -36.0 24.26 Favored 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 -177.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 3.7 pt -59.37 -41.48 84.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 CA-C-N 119.577 1.081 . . . . 0.0 113.551 -176.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.763 ' O ' HG12 ' C' ' 701' ' ' VAL . 12.3 m -56.38 -27.94 25.41 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.894 0 C-N-CA 119.209 -0.996 . . . . 0.0 111.542 -178.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -54.8 -34.83 63.2 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.11 -35.86 65.09 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 119.197 -0.43 . . . . 0.0 111.803 -177.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . 0.763 HG12 ' O ' ' C' ' 698' ' ' VAL . 9.8 p -64.39 -33.08 60.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.339 178.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.89 -40.48 88.89 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.521 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 16.1 m -60.51 -34.87 74.71 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.348 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 24.8 tp -58.29 -42.83 87.45 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.319 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 19.0 m -85.78 -10.8 11.34 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.627 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -61.34 -25.95 67.49 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 120.546 -0.461 . . . . 0.0 111.789 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 1.4 ptp180 -80.07 -21.36 43.48 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 120.455 -0.498 . . . . 0.0 112.252 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 29.5 m -96.12 -29.72 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.0 179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.52 178.03 5.48 Favored 'General case' 0 C--O 1.219 -0.507 0 C-N-CA 120.94 -0.304 . . . . 0.0 110.375 179.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 . . . . . 0 C--O 1.22 -0.494 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.8 -179.793 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.718 ' CD1' ' HB2' ' C' ' 667' ' ' ALA . 29.1 mt . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.485 HD22 ' NE1' ' C' ' 666' ' ' TRP . 5.5 mp -126.31 -142.51 0.29 Allowed 'General case' 0 CA--C 1.55 0.975 0 CA-C-O 118.647 -0.692 . . . . 0.0 109.841 179.846 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . 0.507 ' HA ' HD22 ' B' ' 661' ' ' LEU . 0.8 OUTLIER 73.38 130.94 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 119.429 1.013 . . . . 0.0 109.096 -178.211 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -52.85 -19.2 2.35 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.065 -179.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -63.62 -48.44 77.33 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -71.48 -44.43 64.76 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.73 178.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 88.4 m95 -58.5 -35.23 71.92 Favored 'General case' 0 C--O 1.218 -0.59 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.577 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . . . . . . . . . . . -53.75 -47.36 70.73 Favored 'General case' 0 C--O 1.215 -0.756 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -178.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 12.8 t -53.44 -32.56 50.4 Favored 'General case' 0 C--O 1.215 -0.715 0 C-N-CA 120.192 -0.603 . . . . 0.0 110.321 179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.462 HD12 HG23 ' A' ' 675' ' ' ILE . 0.0 OUTLIER -78.43 -14.56 59.32 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.22 -179.433 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 1.4 m95 -68.46 -17.15 64.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.78 -179.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -68.03 -48.6 65.21 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.534 -178.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . . . . . . . . . 4.7 p90 -103.46 -23.15 13.55 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 121.304 -0.158 . . . . 0.0 111.22 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 50.9 p90 40.58 18.32 0.0 OUTLIER 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 179.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -63.87 -53.12 55.6 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 118.741 0.701 . . . . 0.0 110.945 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.462 HG23 HD12 ' A' ' 669' ' ' LEU . 7.2 tp -68.86 -27.93 37.71 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.912 0 CA-C-N 116.268 -0.423 . . . . 0.0 111.093 179.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 2.0 m -58.96 -39.33 81.36 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.511 -179.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.04 -47.06 86.41 Favored 'General case' 0 C--O 1.212 -0.87 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.597 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . 0.594 ' O ' HG23 ' A' ' 682' ' ' ILE . 4.9 t90 -72.69 -46.25 54.75 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . . . . . . . . . 1.9 tp -75.41 -33.26 60.95 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -176.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 13.8 t90 -89.92 4.78 48.94 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 119.691 -0.803 . . . . 0.0 112.449 -178.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -125.06 2.54 7.97 Favored 'General case' 0 C--O 1.212 -0.919 0 C-N-CA 120.255 -0.578 . . . . 0.0 112.349 179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.594 HG23 ' O ' ' A' ' 678' ' ' TRP . 2.6 pp -55.88 -43.34 74.18 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.684 0 C-N-CA 119.884 -0.727 . . . . 0.0 110.838 -179.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.574 ' N ' HD12 ' A' ' 682' ' ' ILE . 0.0 OUTLIER -70.46 -48.28 56.62 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 121.114 -0.235 . . . . 0.0 110.698 179.705 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 97.2 mt -60.34 -46.72 94.59 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.361 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -52.76 -28.5 22.56 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 -179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.621 HG13 HD12 ' B' ' 686' ' ' ILE . 27.4 mm -58.12 -42.28 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.652 -178.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . . . . . . . . . 47.7 mt -58.28 -41.73 81.88 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 120.031 -0.668 . . . . 0.0 109.342 179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 36.3 mm -57.18 -41.95 78.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.554 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 178.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.435 HG12 ' O ' ' A' ' 689' ' ' VAL . 59.4 t -68.13 -6.42 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.073 0 C-N-CA 120.659 -0.417 . . . . 0.0 111.339 -179.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -70.67 -40.86 65.61 Favored Glycine 0 C--N 1.35 1.338 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 178.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 1.2 m -72.23 -33.46 67.57 Favored 'General case' 0 C--O 1.22 -0.486 0 C-N-CA 120.848 -0.341 . . . . 0.0 110.327 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.68 -47.39 85.53 Favored 'General case' 0 C--O 1.218 -0.565 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.581 -179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.779 ' O ' HD13 ' A' ' 693' ' ' ILE . 0.1 OUTLIER -67.68 -35.14 71.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.641 -179.341 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -66.2 -40.19 94.77 Favored Glycine 0 CA--C 1.531 1.093 0 N-CA-C 110.039 -1.225 . . . . 0.0 110.039 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.583 ' O ' HD23 ' A' ' 695' ' ' LEU . 3.1 tt -56.62 -31.82 64.68 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 115.665 -0.267 . . . . 0.0 111.486 179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 -50.79 -35.26 31.08 Favored 'General case' 0 C--O 1.215 -0.763 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -179.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 20.5 tt -58.49 -40.53 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 -175.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.532 HG22 ' O ' ' A' ' 695' ' ' LEU . 16.0 m -55.69 -28.69 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 119.041 0.837 . . . . 0.0 111.1 -178.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -56.41 -35.93 68.35 Favored 'General case' 0 C--O 1.214 -0.811 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.836 179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -56.55 -50.7 71.11 Favored 'General case' 0 C--O 1.219 -0.511 0 O-C-N 123.262 0.351 . . . . 0.0 111.28 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . . . . . . . . . 22.7 m -68.56 -38.83 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 C-N-CA 120.122 -0.631 . . . . 0.0 110.115 178.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.1 tt -66.17 -24.64 66.68 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.424 179.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 68.9 m -61.68 -44.57 96.69 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.757 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 7.8 tp -64.36 -36.1 83.03 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.065 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 87.4 t -60.79 -36.31 70.43 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.951 179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -60.93 -18.16 55.29 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.883 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . . . . . . . . . 10.2 ttm180 -73.87 -40.32 63.31 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 121.198 -0.201 . . . . 0.0 110.915 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . 0.512 ' O ' HG12 ' A' ' 708' ' ' VAL . 16.3 t -96.14 25.44 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.595 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 42.2 ttm-85 -65.62 123.23 19.13 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.649 -0.42 . . . . 0.0 110.43 179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 8.6 mp0 . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.629 179.808 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.467 HD12 ' N ' ' B' ' 660' ' ' LEU . 7.8 mp . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.507 HD22 ' HA ' ' A' ' 662' ' ' GLU . 19.2 tp 59.77 153.69 0.02 OUTLIER 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 121.623 0.725 . . . . 0.0 111.565 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . 0.402 ' N ' ' HG ' ' B' ' 661' ' ' LEU . 1.3 mp0 -95.62 42.47 1.09 Allowed 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.224 179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . 0.495 HD21 ' N ' ' C' ' 660' ' ' LEU . 7.4 tt -54.6 -41.57 70.09 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 120.672 -0.411 . . . . 0.0 110.986 -179.052 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -75.07 -34.67 61.83 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.725 178.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . . . . . . . . . 11.5 tmtt? -70.57 -34.56 72.33 Favored 'General case' 0 C--O 1.219 -0.551 0 O-C-N 123.44 0.462 . . . . 0.0 110.766 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 30.2 m95 -58.6 -54.8 43.0 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . 0.654 ' HB2' ' HG ' ' C' ' 660' ' ' LEU . . . -70.68 -42.96 70.02 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.666 179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 37.4 t -54.57 -31.28 56.43 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.358 178.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.626 HD11 HG23 ' B' ' 675' ' ' ILE . 0.2 OUTLIER -55.58 -25.65 39.37 Favored 'General case' 0 C--O 1.218 -0.572 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.111 -179.27 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -68.52 -2.81 9.62 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 120.104 -0.638 . . . . 0.0 111.654 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -80.35 -28.7 37.99 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 120.668 -0.413 . . . . 0.0 111.795 -179.249 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . 0.489 ' HB2' HG22 ' B' ' 675' ' ' ILE . 7.4 m95 -87.62 -23.14 24.37 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.521 -179.049 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 66.5 -59.85 0.34 Allowed 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 178.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -57.44 -52.63 64.59 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -177.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.626 HG23 HD11 ' B' ' 669' ' ' LEU . 5.2 tp -68.54 -34.45 65.49 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 C-N-CA 119.914 -0.714 . . . . 0.0 110.811 -179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 1.4 m -60.37 -37.4 80.62 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 120.036 -0.665 . . . . 0.0 110.241 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -59.95 -46.44 89.39 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.759 ' O ' HG23 ' B' ' 682' ' ' ILE . 7.0 t90 -71.64 -30.6 65.93 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.087 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -86.96 -7.51 58.1 Favored 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -179.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -118.25 -20.2 8.66 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 120.642 -0.423 . . . . 0.0 112.102 -179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -95.2 0.87 54.44 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 120.345 -0.542 . . . . 0.0 111.25 179.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.759 HG23 ' O ' ' B' ' 678' ' ' TRP . 4.7 pt -56.39 -43.46 77.52 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.801 0 CA-C-O 119.289 -0.386 . . . . 0.0 111.839 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 25.9 ttp-105 -55.68 -46.55 77.56 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 120.583 -0.447 . . . . 0.0 110.812 -178.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 2.3 mp -67.39 -37.84 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . 0.797 ' HA ' HD12 ' B' ' 688' ' ' ILE . 2.4 t80 -55.32 -41.54 72.56 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.074 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.621 HD12 HG13 ' A' ' 686' ' ' ILE . 3.5 mm -60.95 -45.15 98.95 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 C-N-CA 120.431 -0.508 . . . . 0.0 110.373 -179.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 65.7 mt -58.93 -41.48 83.16 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 N-CA-C 109.46 -0.571 . . . . 0.0 109.46 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . 0.797 HD12 ' HA ' ' B' ' 685' ' ' PHE . 62.2 mt -56.9 -41.87 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.473 ' O ' HG12 ' B' ' 689' ' ' VAL . 47.0 t -68.37 -2.24 1.87 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.12 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.261 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -83.77 -42.73 7.58 Favored Glycine 0 C--N 1.349 1.274 0 N-CA-C 110.483 -1.047 . . . . 0.0 110.483 179.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 68.0 m -73.43 -21.8 60.37 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.932 -0.307 . . . . 0.0 111.063 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.15 -41.63 75.71 Favored 'General case' 0 C--O 1.219 -0.544 0 CA-C-N 116.642 -0.254 . . . . 0.0 110.453 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.667 ' O ' HD12 ' B' ' 693' ' ' ILE . 0.6 OUTLIER -72.25 -32.78 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.525 -179.654 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . 0.551 ' O ' HG22 ' B' ' 697' ' ' ILE . . . -67.3 -47.01 66.07 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 119.661 -1.257 . . . . 0.0 111.419 -179.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.407 ' O ' HG12 ' B' ' 698' ' ' VAL . 0.4 OUTLIER -56.82 -31.77 65.04 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 120.964 -0.294 . . . . 0.0 111.732 -179.019 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.697 ' HG3' HD11 ' A' ' 693' ' ' ILE . 37.0 mmt180 -50.63 -31.11 15.12 Favored 'General case' 0 C--O 1.217 -0.615 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . 0.551 HG22 ' O ' ' B' ' 694' ' ' GLY . 19.0 tt -59.42 -41.1 83.43 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.957 0 N-CA-C 113.129 0.788 . . . . 0.0 113.129 -175.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . 0.522 ' O ' HG22 ' B' ' 701' ' ' VAL . 8.5 p -56.43 -28.72 27.09 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.787 0 CA-C-N 118.474 0.579 . . . . 0.0 111.932 -178.576 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -55.52 -25.79 39.35 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -50.12 -35.6 26.42 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . 0.522 HG22 ' O ' ' B' ' 698' ' ' VAL . 33.3 m -59.85 -33.38 52.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 120.009 -0.676 . . . . 0.0 110.595 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 21.2 tp -61.65 -28.06 69.11 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.314 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 17.3 m -57.98 -34.2 69.71 Favored 'General case' 0 C--O 1.221 -0.447 0 C-N-CA 120.971 -0.292 . . . . 0.0 111.571 -179.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 14.3 tp -77.93 -42.33 33.4 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.748 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 48.8 t -66.3 -13.58 16.25 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.345 -179.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -60.84 -34.2 74.2 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.973 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 76.4 mtt-85 -76.13 -35.68 59.15 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 120.734 -0.386 . . . . 0.0 111.049 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.516 HG12 ' O ' ' B' ' 708' ' ' VAL . 16.6 t -89.1 26.07 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.521 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -60.15 116.38 4.16 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.554 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.219 -0.505 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.702 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . 0.654 ' HG ' ' HB2' ' B' ' 667' ' ' ALA . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 5.7 mt -117.39 151.55 36.8 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.013 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -174.0 -177.9 1.42 Allowed 'General case' 0 C--O 1.22 -0.493 0 O-C-N 123.306 0.379 . . . . 0.0 110.186 -179.509 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.65 -40.13 86.68 Favored 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 120.873 0.368 . . . . 0.0 110.454 179.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.35 -28.99 66.69 Favored 'General case' 0 C--O 1.218 -0.562 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.56 179.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 32.9 tptt -70.11 -43.29 71.34 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.849 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . 0.485 ' NE1' HD22 ' A' ' 661' ' ' LEU . 88.0 m95 -73.04 -49.16 30.27 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.088 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . 0.718 ' HB2' ' CD1' ' A' ' 660' ' ' LEU . . . -62.18 -14.73 40.55 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 120.656 -0.417 . . . . 0.0 111.664 -179.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 60.3 p -65.71 -31.69 72.83 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.533 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . 0.461 HD23 HD11 ' C' ' 675' ' ' ILE . 8.6 mp -77.51 -6.06 52.23 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -72.12 -28.55 63.34 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -62.72 -49.89 73.25 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 118.633 -1.227 . . . . 0.0 110.756 -178.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . 0.418 ' O ' ' N ' ' C' ' 674' ' ' ASP . 6.1 p90 -95.86 -23.35 16.95 Favored 'General case' 0 CA--C 1.568 1.639 0 N-CA-C 115.034 1.494 . . . . 0.0 115.034 179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 51.6 p90 38.66 19.12 0.0 OUTLIER 'General case' 0 C--N 1.363 1.168 0 N-CA-C 115.075 1.509 . . . . 0.0 115.075 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . 0.418 ' N ' ' O ' ' C' ' 672' ' ' TRP . 1.0 OUTLIER -64.19 -54.0 40.48 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 119.107 -1.037 . . . . 0.0 110.448 179.855 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . 0.466 ' C ' HD12 ' C' ' 675' ' ' ILE . 1.5 pp -70.15 -33.56 55.32 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.65 0 CA-C-O 121.159 0.504 . . . . 0.0 110.491 177.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 21.0 m -58.64 -33.95 70.64 Favored 'General case' 0 C--O 1.218 -0.582 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.796 -177.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -59.9 -47.94 83.73 Favored 'General case' 0 C--O 1.218 -0.605 0 C-N-CA 119.481 -0.888 . . . . 0.0 109.961 -179.117 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . 0.525 ' HD1' HD11 ' C' ' 682' ' ' ILE . 0.0 OUTLIER -73.43 -46.05 50.86 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 120.652 -0.419 . . . . 0.0 111.121 178.728 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 2.5 tt -67.62 -33.44 74.98 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 113.544 0.942 . . . . 0.0 113.544 -175.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 7.5 t90 -80.12 -17.27 53.01 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.4 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -93.03 -6.43 48.27 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.519 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . 0.58 ' O ' HD13 ' C' ' 686' ' ' ILE . 50.2 mm -56.04 -47.6 80.06 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -58.08 -42.01 84.68 Favored 'General case' 0 C--O 1.219 -0.517 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.3 178.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 41.4 mm -61.2 -48.53 88.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.861 -178.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.691 ' HA ' HD12 ' C' ' 688' ' ' ILE . 11.7 m-85 -69.63 -28.87 66.28 Favored 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -178.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.58 HD13 ' O ' ' C' ' 682' ' ' ILE . 1.2 mp -58.25 -50.04 79.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.584 -178.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 40.5 mt -59.08 -41.36 83.24 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.584 0 C-N-CA 120.36 -0.536 . . . . 0.0 109.629 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' C' ' 685' ' ' PHE . 84.1 mt -56.67 -41.88 75.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 58.6 t -67.88 -31.41 52.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.6 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -56.88 -43.44 92.54 Favored Glycine 0 CA--C 1.537 1.417 0 CA-C-N 119.147 0.885 . . . . 0.0 111.66 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 11.8 m -78.59 -20.31 50.77 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 117.501 0.651 . . . . 0.0 112.122 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.5 tp -59.72 -32.95 71.01 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.096 -178.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . . . . . . . . . 2.2 pp -65.47 -36.47 77.75 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 C-N-CA 120.449 -0.501 . . . . 0.0 110.38 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -58.68 -36.84 87.91 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 120.74 -0.743 . . . . 0.0 111.489 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . . . . . . . . . 7.8 tt -56.42 -32.83 65.24 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 117.481 0.64 . . . . 0.0 111.156 -179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.84 -36.68 38.84 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-O 120.371 0.129 . . . . 0.0 111.28 178.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . . . . . . . . . 53.5 mt -59.82 -42.03 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.175 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.544 ' O ' HG12 ' C' ' 701' ' ' VAL . 39.4 t -70.91 -33.5 52.33 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.228 179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . 0.437 ' O ' HD23 ' C' ' 702' ' ' LEU . 0.1 OUTLIER -57.9 -35.48 71.1 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.816 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -55.73 -35.0 65.66 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . 0.544 HG12 ' O ' ' C' ' 698' ' ' VAL . 7.0 p -59.15 -31.83 46.77 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 119.989 -0.685 . . . . 0.0 111.389 -178.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . 0.437 HD23 ' O ' ' C' ' 699' ' ' PHE . 1.3 pp -58.96 -25.1 63.25 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.672 179.789 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 26.1 p -57.86 -40.38 80.02 Favored 'General case' 0 C--O 1.22 -0.495 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.052 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . . . . . . . . . 14.7 tp -59.02 -31.43 68.82 Favored 'General case' 0 C--O 1.217 -0.615 0 C-N-CA 120.523 -0.471 . . . . 0.0 109.786 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 11.7 t -81.09 -38.14 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.976 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 23.4 t30 -61.1 -8.55 3.52 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -178.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . . . . . . . . . 3.0 ppt_? -81.76 -14.67 56.15 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 45.2 t -83.0 -36.18 12.78 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 C-N-CA 120.722 -0.391 . . . . 0.0 110.262 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 21.2 ptt-85 -153.74 173.25 16.09 Favored 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.771 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 69.7 tp60 . . . . . 0 C--O 1.22 -0.471 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.305 179.866 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 660' ' ' LEU . . . . . 0.498 ' C ' HD12 ' A' ' 661' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.498 1.941 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 661' ' ' LEU . . . . . 0.698 HD11 ' C9 ' ' A' ' 801' ' ' QOJ . 10.5 mp -118.76 136.15 54.13 Favored 'General case' 0 C--O 1.22 -0.49 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.662 -179.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 61.1 mt-10 -141.98 152.29 43.31 Favored 'General case' 0 C--O 1.218 -0.58 0 C-N-CA 120.637 -0.425 . . . . 0.0 111.072 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 663' ' ' LEU . . . . . . . . . . . . . 5.3 tt -61.7 -39.84 92.9 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.141 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 664' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.62 -26.27 62.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.618 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 665' ' ' LYS . . . . . . . . . . . . . 19.1 tptt -70.49 -46.11 64.37 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-O 120.852 0.358 . . . . 0.0 111.182 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 666' ' ' TRP . . . . . . . . . . . . . 64.1 m95 -71.82 -47.67 51.61 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.142 -178.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 667' ' ' ALA . . . . . 0.594 ' HB2' ' HG ' ' B' ' 660' ' ' LEU . . . -59.54 -39.3 83.51 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 120.305 -0.558 . . . . 0.0 111.608 -178.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 668' ' ' SER . . . . . . . . . . . . . 20.5 t -58.4 -32.03 68.24 Favored 'General case' 0 C--O 1.218 -0.565 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.895 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 669' ' ' LEU . . . . . 0.656 HD21 HG22 ' A' ' 675' ' ' ILE . 2.9 tm? -60.15 -25.01 65.18 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.211 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 670' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -68.43 -3.11 10.2 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 118.915 -0.564 . . . . 0.0 112.24 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 671' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -74.85 -50.09 18.25 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 119.128 -1.029 . . . . 0.0 112.6 -178.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 672' ' ' TRP . . . . . 0.411 ' HD1' ' H ' ' A' ' 672' ' ' TRP . 1.0 OUTLIER -104.96 -9.86 17.64 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-N 118.619 0.645 . . . . 0.0 111.798 177.2 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 673' ' ' PHE . . . . . . . . . . . . . 1.5 t80 52.06 17.17 0.64 Allowed 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 176.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 674' ' ' ASP . . . . . 0.406 ' HB2' ' CE3' ' A' ' 672' ' ' TRP . 35.4 t70 -63.73 -52.74 59.13 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.044 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 675' ' ' ILE . . . . . 0.656 HG22 HD21 ' A' ' 669' ' ' LEU . 0.4 OUTLIER -68.38 -34.61 66.8 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 119.486 -0.886 . . . . 0.0 111.699 -178.384 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 676' ' ' THR . . . . . 0.496 ' OG1' HD11 ' A' ' 669' ' ' LEU . 0.0 OUTLIER -58.95 -33.78 71.02 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.961 -0.295 . . . . 0.0 111.121 -179.185 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 677' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -59.38 -46.79 87.68 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 119.805 -0.758 . . . . 0.0 111.153 -178.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 678' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -72.9 -46.46 52.54 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 679' ' ' LEU . . . . . 0.455 HD12 HD12 ' A' ' 675' ' ' ILE . 96.2 mt -84.61 -19.74 32.51 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.742 1.386 . . . . 0.0 114.742 -174.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 680' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -83.91 13.57 4.81 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.728 177.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 681' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -130.7 -35.48 1.46 Allowed 'General case' 0 C--N 1.35 0.62 0 N-CA-C 109.962 -0.385 . . . . 0.0 109.962 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 682' ' ' ILE . . . . . 0.496 HD13 ' O ' ' A' ' 682' ' ' ILE . 0.0 OUTLIER -55.57 -36.77 43.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 120.806 -0.358 . . . . 0.0 110.057 178.629 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 18.2 ttp180 -60.18 -48.78 80.29 Favored 'General case' 0 C--N 1.349 0.553 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.14 179.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.32 -43.32 97.94 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 178.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 685' ' ' PHE . . . . . 0.603 ' O ' HG23 ' A' ' 689' ' ' VAL . 10.1 t80 -52.74 -27.67 18.78 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 686' ' ' ILE . . . . . 0.711 ' CD1' HG21 ' C' ' 686' ' ' ILE . 38.7 mm -57.64 -51.57 68.32 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.236 -177.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 687' ' ' ILE . . . . . 0.491 ' H ' HD12 ' A' ' 687' ' ' ILE . 4.2 mp -61.77 -41.65 91.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 120.191 -0.604 . . . . 0.0 110.253 179.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 688' ' ' ILE . . . . . . . . . . . . . 90.6 mt -56.54 -40.34 67.81 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.438 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 689' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 685' ' ' PHE . 57.5 t -67.12 -2.14 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 119.905 -0.718 . . . . 0.0 111.22 -177.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 690' ' ' GLY . . . . . . . . . . . . . . . -73.99 -49.36 13.36 Favored Glycine 0 C--N 1.349 1.252 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 177.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 691' ' ' SER . . . . . . . . . . . . . 35.4 m -66.47 -22.48 66.2 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.771 -0.372 . . . . 0.0 110.925 178.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.79 -32.93 54.35 Favored 'General case' 0 C--O 1.218 -0.562 0 C-N-CA 121.047 -0.261 . . . . 0.0 110.312 -179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 693' ' ' ILE . . . . . 0.454 HG22 HG21 ' C' ' 693' ' ' ILE . 1.3 pp -80.58 -35.62 15.24 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.238 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 694' ' ' GLY . . . . . . . . . . . . . . . -62.2 -45.5 95.9 Favored Glycine 0 C--N 1.342 0.911 0 N-CA-C 110.603 -0.999 . . . . 0.0 110.603 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.748 ' O ' HG22 ' A' ' 698' ' ' VAL . 1.6 tt -56.57 -42.17 78.17 Favored 'General case' 0 C--O 1.213 -0.828 0 N-CA-C 110.246 -0.279 . . . . 0.0 110.246 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 696' ' ' ARG . . . . . 0.456 ' HE ' HD12 ' C' ' 693' ' ' ILE . 54.0 mmt-85 -50.74 -33.92 24.99 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 122.702 0.401 . . . . 0.0 112.001 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 697' ' ' ILE . . . . . . . . . . . . . 66.9 mt -56.95 -39.98 69.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.824 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.765 -176.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 698' ' ' VAL . . . . . 0.748 HG22 ' O ' ' A' ' 695' ' ' LEU . 17.1 m -55.48 -28.19 22.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 118.874 0.761 . . . . 0.0 110.787 -179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 699' ' ' PHE . . . . . . . . . . . . . 31.9 m-85 -57.95 -36.68 72.88 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.678 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 700' ' ' ALA . . . . . . . . . . . . . . . -60.05 -50.44 73.72 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.746 -0.382 . . . . 0.0 110.931 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 701' ' ' VAL . . . . . 0.447 HG12 ' O ' ' A' ' 698' ' ' VAL . 7.6 p -67.2 -36.97 78.25 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 702' ' ' LEU . . . . . . . . . . . . . 3.7 tt -60.97 -25.75 67.07 Favored 'General case' 0 CA--C 1.549 0.915 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 703' ' ' SER . . . . . . . . . . . . . 1.3 m -57.97 -44.36 87.02 Favored 'General case' 0 C--O 1.219 -0.537 0 C-N-CA 121.163 -0.215 . . . . 0.0 110.89 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 3.6 tt -73.24 -27.77 61.77 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 120.844 -0.342 . . . . 0.0 111.096 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 705' ' ' VAL . . . . . . . . . . . . . 66.2 t -60.87 -29.47 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 N-CA-C 109.975 -0.379 . . . . 0.0 109.975 179.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 706' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -60.75 -17.55 49.36 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.421 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 707' ' ' ARG . . . . . 0.44 ' CZ ' ' CZ ' ' C' ' 707' ' ' ARG . 0.0 OUTLIER -73.85 -34.72 64.63 Favored 'General case' 0 C--O 1.219 -0.521 0 C-N-CA 121.108 -0.237 . . . . 0.0 110.799 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 708' ' ' VAL . . . . . . . . . . . . . 22.0 t -82.82 -26.74 8.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.331 -179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 66.29 111.49 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 110.465 -0.198 . . . . 0.0 110.465 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 710' ' ' GLN . . . . . . . . . . . . . 45.1 tp60 . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.414 179.875 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 660' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' A' ' 667' ' ' ALA . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 661' ' ' LEU . . . . . 0.429 HD12 ' H ' ' B' ' 661' ' ' LEU . 8.1 mp -50.47 135.53 22.25 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 121.199 -0.2 . . . . 0.0 110.775 179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 662' ' ' GLU . . . . . . . . . . . . . 18.6 mt-10 -157.27 164.42 37.68 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 120.547 -0.461 . . . . 0.0 111.583 -179.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 8.6 tt -56.08 -40.57 73.81 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.106 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 664' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -74.28 -29.41 61.65 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.041 178.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 665' ' ' LYS . . . . . 0.415 ' O ' HD13 ' B' ' 669' ' ' LEU . 1.1 tmtp? -61.11 -44.29 97.57 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.332 -178.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 666' ' ' TRP . . . . . . . . . . . . . 93.6 m95 -69.94 -51.14 35.29 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -178.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 667' ' ' ALA . . . . . . . . . . . . . . . -71.8 -23.52 61.58 Favored 'General case' 0 C--O 1.217 -0.633 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 668' ' ' SER . . . . . . . . . . . . . 10.5 m -66.11 -31.78 72.84 Favored 'General case' 0 C--O 1.218 -0.582 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.368 179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 669' ' ' LEU . . . . . 0.415 HD13 ' O ' ' B' ' 665' ' ' LYS . 4.7 mp -64.74 -22.03 66.89 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 120.921 -0.312 . . . . 0.0 111.788 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 670' ' ' TRP . . . . . . . . . . . . . 24.5 m95 -68.7 -9.04 48.01 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 671' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -89.11 -47.64 7.96 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -176.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 672' ' ' TRP . . . . . . . . . . . . . 1.0 OUTLIER -103.14 -12.96 16.99 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 118.496 2.776 . . . . 0.0 118.496 -174.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 673' ' ' PHE . . . . . 0.463 ' HB3' HG22 ' B' ' 675' ' ' ILE . 1.4 t80 -156.75 156.31 33.11 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-N 122.914 2.597 . . . . 0.0 117.309 -178.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 674' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -63.54 -29.42 70.69 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 112.583 -2.098 . . . . 0.0 112.274 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 675' ' ' ILE . . . . . 0.463 HG22 ' HB3' ' B' ' 673' ' ' PHE . 7.2 tp -55.11 -27.0 18.9 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.58 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -176.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 11.7 m -58.59 -38.95 79.02 Favored 'General case' 0 C--O 1.22 -0.475 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 677' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.67 -36.2 70.56 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.381 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 678' ' ' TRP . . . . . 0.458 ' CE3' HD11 ' B' ' 675' ' ' ILE . 34.9 t90 -55.79 -39.76 71.74 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 116.749 -0.205 . . . . 0.0 110.574 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.56 -14.99 59.97 Favored 'General case' 0 C--O 1.219 -0.538 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 680' ' ' TRP . . . . . 0.478 ' HZ3' ' HH ' ' B' ' 681' ' ' TYR . 16.8 t90 -101.84 -4.78 25.71 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 -179.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 681' ' ' TYR . . . . . 0.478 ' HH ' ' HZ3' ' B' ' 680' ' ' TRP . 59.8 m-85 -125.7 -2.25 7.29 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 120.328 -0.549 . . . . 0.0 112.108 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 7.1 tp -68.07 -40.39 83.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 120.344 -0.542 . . . . 0.0 111.999 -178.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 683' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -60.35 -43.77 96.16 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.874 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 684' ' ' ILE . . . . . . . . . . . . . 78.0 mt -68.2 -41.8 84.26 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.594 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 685' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -52.98 -28.65 24.84 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.544 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 686' ' ' ILE . . . . . 0.787 HG21 HD12 ' C' ' 686' ' ' ILE . 21.6 mm -59.32 -42.78 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.539 -179.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 687' ' ' ILE . . . . . . . . . . . . . 56.4 mt -58.3 -41.78 82.06 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -179.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 688' ' ' ILE . . . . . 0.51 HD12 ' N ' ' B' ' 688' ' ' ILE . 3.0 mp -62.05 -42.01 93.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 178.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 689' ' ' VAL . . . . . 0.629 ' O ' HD11 ' B' ' 692' ' ' LEU . 59.3 t -68.89 -0.99 1.44 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.164 0 C-N-CA 120.41 -0.516 . . . . 0.0 111.324 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 690' ' ' GLY . . . . . . . . . . . . . . . -104.93 7.09 44.33 Favored Glycine 0 CA--C 1.541 1.712 0 C-N-CA 120.634 -0.793 . . . . 0.0 111.902 179.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 691' ' ' SER . . . . . . . . . . . . . 3.2 m -88.53 -34.35 17.43 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-N 117.374 0.587 . . . . 0.0 111.348 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 692' ' ' LEU . . . . . 0.629 HD11 ' O ' ' B' ' 689' ' ' VAL . 0.2 OUTLIER -65.3 -32.69 74.48 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 120.691 -0.403 . . . . 0.0 111.663 -178.71 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 693' ' ' ILE . . . . . 0.822 HD11 ' HG3' ' C' ' 696' ' ' ARG . 0.8 OUTLIER -57.26 -46.16 85.01 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.37 -178.912 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 694' ' ' GLY . . . . . . . . . . . . . . . -71.2 -41.66 59.38 Favored Glycine 0 CA--C 1.532 1.111 0 N-CA-C 109.378 -1.489 . . . . 0.0 109.378 178.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 695' ' ' LEU . . . . . 0.428 HD23 ' C ' ' B' ' 695' ' ' LEU . 10.5 tt -56.58 -34.9 67.61 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.595 -0.302 . . . . 0.0 111.438 179.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 696' ' ' ARG . . . . . 0.43 HH11 HD13 ' B' ' 693' ' ' ILE . 11.7 mtm105 -50.69 -31.59 16.86 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 697' ' ' ILE . . . . . . . . . . . . . 42.3 mm -59.62 -41.34 84.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 698' ' ' VAL . . . . . . . . . . . . . 43.1 t -56.33 -28.66 26.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 N-CA-C 111.866 0.321 . . . . 0.0 111.866 -178.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 699' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -56.03 -29.21 60.07 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 120.214 -0.594 . . . . 0.0 111.678 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 700' ' ' ALA . . . . . . . . . . . . . . . -51.43 -35.92 41.54 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.776 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 701' ' ' VAL . . . . . . . . . . . . . 79.7 t -60.43 -32.3 50.84 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.851 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 702' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.28 -25.82 67.81 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.257 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 703' ' ' SER . . . . . . . . . . . . . 23.2 t -57.44 -37.42 72.79 Favored 'General case' 0 C--O 1.22 -0.492 0 C-N-CA 121.14 -0.224 . . . . 0.0 111.24 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 704' ' ' LEU . . . . . . . . . . . . . 26.0 tp -64.62 -31.47 72.71 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.029 179.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 705' ' ' VAL . . . . . . . . . . . . . 22.0 t -88.1 -21.94 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.035 -179.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 706' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -61.04 -25.78 67.16 Favored 'General case' 0 C--O 1.219 -0.54 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.754 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 707' ' ' ARG . . . . . . . . . . . . . 68.1 mtp85 -73.7 -49.84 23.79 Favored 'General case' 0 C--O 1.219 -0.5 0 C-N-CA 120.614 -0.434 . . . . 0.0 111.114 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 708' ' ' VAL . . . . . 0.529 HG12 ' O ' ' B' ' 708' ' ' VAL . 18.1 t -104.54 26.1 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.778 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.545 -179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 57.5 ttt85 -53.92 146.83 13.34 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 121.036 -0.266 . . . . 0.0 110.628 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? . . . . . 0 C--O 1.22 -0.454 0 CA-C-O 117.969 -1.015 . . . . 0.0 110.488 179.771 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 660' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 661' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 50.67 -176.0 0.02 OUTLIER 'General case' 0 C--O 1.215 -0.721 0 CA-C-O 120.615 0.245 . . . . 0.0 111.558 178.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 662' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -159.87 158.84 31.64 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 179.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 663' ' ' LEU . . . . . 0.489 HD21 ' HB2' ' A' ' 660' ' ' LEU . 1.7 tm? -62.65 -40.73 97.96 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.213 -0.595 . . . . 0.0 110.245 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 664' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -74.53 -24.24 58.94 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.982 178.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 665' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -66.84 -39.5 87.63 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 120.884 -0.326 . . . . 0.0 111.12 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 666' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -60.25 -47.97 83.73 Favored 'General case' 0 C--O 1.219 -0.538 0 C-N-CA 120.233 -0.587 . . . . 0.0 110.067 179.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 667' ' ' ALA . . . . . . . . . . . . . . . -62.34 -29.35 70.39 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.73 -179.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 668' ' ' SER . . . . . . . . . . . . . 19.3 t -64.41 -34.18 77.59 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.162 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 669' ' ' LEU . . . . . . . . . . . . . 6.1 mp -68.68 -4.66 16.49 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 670' ' ' TRP . . . . . . . . . . . . . 10.3 m0 -70.77 -28.81 64.95 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 671' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -62.63 -49.64 74.4 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.934 -177.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 672' ' ' TRP . . . . . 0.428 ' O ' ' N ' ' C' ' 674' ' ' ASP . 2.4 p90 -92.93 -22.67 19.08 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 115.635 1.717 . . . . 0.0 115.635 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 673' ' ' PHE . . . . . . . . . . . . . 20.4 p90 43.28 8.86 0.0 OUTLIER 'General case' 0 C--N 1.359 1.015 0 N-CA-C 115.648 1.721 . . . . 0.0 115.648 179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 674' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' C' ' 672' ' ' TRP . 9.2 t70 -64.24 -53.81 43.22 Favored 'General case' 0 C--N 1.349 0.586 0 CA-C-N 120.007 1.276 . . . . 0.0 110.63 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 675' ' ' ILE . . . . . . . . . . . . . 7.8 tp -69.76 -33.22 55.22 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.718 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.243 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 676' ' ' THR . . . . . . . . . . . . . 13.4 m -58.85 -41.89 88.05 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -177.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 677' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -63.22 -43.66 97.47 Favored 'General case' 0 C--O 1.213 -0.829 0 C-N-CA 119.635 -0.826 . . . . 0.0 111.297 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 678' ' ' TRP . . . . . . . . . . . . . 3.1 t90 -72.51 -45.88 57.28 Favored 'General case' 0 CA--C 1.547 0.843 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 679' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.62 -27.03 55.57 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -177.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 680' ' ' TRP . . . . . . . . . . . . . 6.0 t90 -92.93 7.91 42.0 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 119.995 -0.682 . . . . 0.0 112.52 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 681' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -137.51 3.68 2.56 Favored 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 120.507 -0.477 . . . . 0.0 111.858 179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 682' ' ' ILE . . . . . . . . . . . . . 3.9 tp -64.19 -41.89 93.81 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.063 -179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 683' ' ' ARG . . . . . . . . . . . . . 4.6 ptt-85 -58.25 -43.45 87.87 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.159 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 684' ' ' ILE . . . . . . . . . . . . . 82.5 mt -68.23 -39.87 81.82 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.616 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 177.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 685' ' ' PHE . . . . . 0.539 ' HA ' HD12 ' C' ' 688' ' ' ILE . 0.4 OUTLIER -53.39 -28.86 31.74 Favored 'General case' 0 C--O 1.218 -0.559 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.07 -179.6 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 686' ' ' ILE . . . . . 0.787 HD12 HG21 ' B' ' 686' ' ' ILE . 24.0 mm -59.78 -44.29 93.6 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.518 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.843 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 687' ' ' ILE . . . . . . . . . . . . . 54.7 mt -58.22 -41.51 81.12 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.539 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 688' ' ' ILE . . . . . 0.539 HD12 ' HA ' ' C' ' 685' ' ' PHE . 31.3 mt -57.59 -41.86 80.01 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 689' ' ' VAL . . . . . . . . . . . . . 31.2 t -67.96 -31.23 51.11 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 CA-C-O 119.021 -0.514 . . . . 0.0 111.736 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 690' ' ' GLY . . . . . . . . . . . . . . . -67.08 -62.22 4.62 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 119.132 0.878 . . . . 0.0 111.001 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 691' ' ' SER . . . . . . . . . . . . . 1.3 m -51.63 -22.27 3.24 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 116.9 0.35 . . . . 0.0 111.405 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 tp -57.46 -32.85 67.36 Favored 'General case' 0 C--O 1.219 -0.539 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.127 -179.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 693' ' ' ILE . . . . . 0.456 HD12 ' HE ' ' A' ' 696' ' ' ARG . 1.2 pt -73.63 -24.86 20.28 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 120.37 -0.532 . . . . 0.0 111.392 -179.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 694' ' ' GLY . . . . . . . . . . . . . . . -61.81 -55.13 30.22 Favored Glycine 0 CA--C 1.539 1.583 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.865 -179.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 695' ' ' LEU . . . . . 0.658 ' O ' HD23 ' C' ' 695' ' ' LEU . 2.1 tt -56.83 -31.96 65.26 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 117.044 0.422 . . . . 0.0 111.945 -179.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 696' ' ' ARG . . . . . 0.822 ' HG3' HD11 ' B' ' 693' ' ' ILE . 6.9 mmt180 -50.57 -34.34 25.34 Favored 'General case' 0 C--O 1.212 -0.885 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 697' ' ' ILE . . . . . 0.715 HD13 ' O ' ' C' ' 697' ' ' ILE . 0.2 OUTLIER -57.66 -40.43 75.33 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 CA-C-O 118.688 -0.673 . . . . 0.0 112.427 -175.361 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 698' ' ' VAL . . . . . 0.499 HG12 ' O ' ' C' ' 695' ' ' LEU . 7.8 p -55.92 -29.2 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 CA-C-N 119.502 1.046 . . . . 0.0 111.185 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 699' ' ' PHE . . . . . 0.417 ' HB2' ' O ' ' C' ' 696' ' ' ARG . 0.3 OUTLIER -56.71 -34.42 67.45 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.722 179.449 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' C' C ' 700' ' ' ALA . . . . . . . . . . . . . . . -54.72 -35.25 63.47 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 119.294 -0.384 . . . . 0.0 111.573 -176.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 701' ' ' VAL . . . . . . . . . . . . . 79.4 t -59.68 -32.16 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 C-N-CA 120.001 -0.68 . . . . 0.0 109.836 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 702' ' ' LEU . . . . . . . . . . . . . 9.6 tt -59.26 -28.8 67.06 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.496 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 703' ' ' SER . . . . . . . . . . . . . 4.0 t -63.48 -38.41 91.04 Favored 'General case' 0 C--O 1.219 -0.547 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.364 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 704' ' ' LEU . . . . . 0.432 HD11 ' HE ' ' A' ' 707' ' ' ARG . 15.0 tp -54.9 -30.98 59.59 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.083 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 705' ' ' VAL . . . . . . . . . . . . . 41.3 t -75.44 -26.44 18.46 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.62 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.41 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 706' ' ' ASN . . . . . . . . . . . . . 40.9 t30 -60.65 -16.93 43.99 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -178.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 707' ' ' ARG . . . . . 0.44 ' CZ ' ' CZ ' ' A' ' 707' ' ' ARG . 6.7 ptm180 -74.94 -32.38 61.73 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 120.694 -0.402 . . . . 0.0 111.276 -179.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 708' ' ' VAL . . . . . . . . . . . . . 35.4 t -82.79 -30.1 8.69 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.649 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.187 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 709' ' ' ARG . . . . . . . . . . . . . 11.5 tpt85 55.13 -85.71 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.916 0 CA-C-O 119.264 -0.398 . . . . 0.0 111.958 179.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 710' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 . . . . . 0 C--N 1.346 0.426 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.455 -179.615 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 801' ' ' QOJ . . . . . 0.698 ' C9 ' HD11 ' A' ' 661' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 801' ' ' QOJ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_